A0A077ZN55_TRITR Loading...

Major sperm protein

Central component in molecular interactions underlying sperm crawling. Forms an extensive filament system that extends from sperm villipoda, along the leading edge of the pseudopod.

AlphaFold DB , UniProt , Accession A0A077ZN55, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 235 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.6	Very low	51.6	Low	217 Å²	217	120.8 Å²	120.8	100%	1.069	65%	0.65	S	S	*	*				0	113.6	0	-76	174.6	171.3	0	0	107.1	F3	M1-F3 HydrophobicContact CB-CE2 4.47Å
2	E	40.5	Very low	55.1	Low	190 Å²	190	110.8 Å²	110.8	89%	0.888	60%	0.596	S	S	*	*			trans	-83.8	125.4	167	-65.2	-176	125.3	0	0	108	V4	E2-V4 PolarHBondContact O-N 3.31Å
3	F	47.7	Very low	58.1	Low	144 Å²	144	106.1 Å²	106.1	63%	0.632	57%	0.568	S	S	*	*			trans	-84.9	97.7	174.4	-68.2	-82.7	0	0	0	108	M1 S5	M1-F3 HydrophobicContact CB-CE2 4.47Å; F3-S5 PolarHBondContact O-N 3.04Å
4	V	42.5	Very low	60.9	Low	139 Å²	139	99.4 Å²	99.4	84%	0.842	53%	0.532	S	S	*	.			trans	-55.3	114.2	174	178.1	0	0	0	0	108.3	E2 G6	E2-V4 PolarHBondContact O-N 3.31Å; V4-G6 PolarHBondContact O-N 3.27Å
5	S	46.7	Very low	63.3	Low	116 Å²	116	99.3 Å²	99.3	81%	0.811	52%	0.523	S	S	*	.			trans	-78.7	61.4	-173.6	-158.8	0	0	0	0	111.5	F3	F3-S5 PolarHBondContact O-N 3.04Å
6	G	45.3	Very low	65.3	Low	48 Å²	48	96.9 Å²	96.9	50%	0.495	52%	0.515	S	S	.	.			trans	-62.2	135.3	165.7	0	0	0	0	0	109.4	V4 R8	V4-G6 PolarHBondContact O-N 3.27Å; G6-R8 VanDerWaalsContact C-N 3.28Å; G6-R8 PolarHBondContact O-N 2.94Å
7	S	49.9	Very low	66.9	Low	114 Å²	114	96.6 Å²	96.6	80%	0.797	52%	0.518	S	S	*	.			trans	-73.9	70.7	-166.9	46	0	0	0	0	113.8	K9	S7-K9 PolarHBondContact O-N 2.78Å
8	R	55	Low	68.3	Low	123 Å²	123	97.2 Å²	97.2	46%	0.464	52%	0.521	S	S	.	.			trans	-61	100.6	172.3	-58.7	-165.1	-162.8	-137.6	1	109.7	G6 A10 E42 V97	G6-R8 VanDerWaalsContact C-N 3.28Å; G6-R8 PolarHBondContact O-N 2.94Å; R8-A10 VanDerWaalsContact C-N 3.26Å; R8-A10 PolarHBondContact O-N 2.88Å; R8-E42 IonicContact CZ-OE1 3.65Å; R8-E42 IonicContact NH1-OE1 3.12Å; R8-E42 PolarHBondContact NH1-OE1 3.34Å; R8-V97 HydrophobicContact CB-CG2 4.3Å
9	K	59.8	Low	69.6	Low	181 Å²	181	93.1 Å²	93.1	79%	0.787	50%	0.499	S	S	*	.			trans	-73	81.1	174.2	-72.3	-175.4	177.9	179.5	0	109.4	S7 T11	S7-K9 PolarHBondContact O-N 2.78Å; K9-T11 VanDerWaalsContact C-N 3.32Å; K9-T11 PolarHBondContact O-N 2.81Å
10	A	61.5	Low	70.9	Confident	6 Å²	6	88.6 Å²	88.6	5%	0.05	48%	0.475	C	S	.	.			trans	-66.4	83.4	179.4	0	0	0	0	0	112	R8 V12 V97 D121 K122	R8-A10 VanDerWaalsContact C-N 3.26Å; R8-A10 PolarHBondContact O-N 2.88Å; A10-V12 PolarHBondContact O-N 2.83Å; A10-V97 HydrophobicContact CB-CG2 3.85Å; A10-D121 HydrophobicContact CB-CB 3.42Å; A10-D121 VanDerWaalsContact CB-CB 3.42Å; A10-K122 VanDerWaalsContact O-CD 3.23Å; A10-K122 WeakPolarHBondContact O-CD 3.26Å
11	T	78.7	Confident	71.8	Confident	51 Å²	51	88.8 Å²	88.8	31%	0.313	47%	0.473	S	S	.	.			trans	-79.9	63.1	-178.3	41.5	0	0	0	0	112.3	K9 N39	K9-T11 VanDerWaalsContact C-N 3.32Å; K9-T11 PolarHBondContact O-N 2.81Å; T11-N39 PolarHBondContact O-N 2.66Å; T11-N39 PolarHBondContact OG1-O 2.97Å
12	V	93.4	Very high	74.2	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	131.6	156.2	70.3	0	0	0	0	109.3	A10 L36 Y37 I44 L65 A95 K122	A10-V12 PolarHBondContact O-N 2.83Å; V12-L36 HydrophobicContact CG2-CB 4.45Å; V12-Y37 CarbonylContact C-O 3.49Å; V12-Y37 VanDerWaalsContact CA-O 3.32Å; V12-Y37 WeakPolarHBondContact CA-O 3.4Å; V12-Y37 WeakPolarHBondContact CG2-O 3.34Å; V12-I44 HydrophobicContact CB-CD1 4.21Å; V12-L65 HydrophobicContact CG2-CD1 3.8Å; V12-A95 HydrophobicContact CB-CB 4.23Å; V12-A95 HydrophobicContact CG1-CB 3.48Å; V12-A95 VanDerWaalsContact CG1-CB 3.48Å; V12-K122 HydrophobicContact CG1-CB 4.36Å; V12-K122 HydrophobicContact CG1-CD 3.97Å; V12-K122 HydrophobicContact CG1-CG 4.4Å; V12-K122 PolarHBondContact O-NZ 2.9Å
13	E	95	Very high	76.3	Confident	50 Å²	50	71.6 Å²	71.6	23%	0.234	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	152.2	175.1	-71.7	160.9	-155.7	0	0	109.2	Y15 L36 Y37 N39	E13-Y15 HydrophobicContact CB-CE2 3.89Å; E13-Y15 PolarHBondContact OE2-OH 3.42Å; E13-L36 WeakPolarHBondContact O-CA 3.35Å; E13-Y37 PolarHBondContact N-O 2.79Å; E13-Y37 PolarHBondContact O-N 2.83Å; E13-Y37 WeakPolarHBondContact OE2-CD1 3.37Å; E13-N39 WeakPolarHBondContact OE1-CB 3.43Å; E13-N39 PolarHBondContact OE1-ND2 2.91Å
14	V	96.7	Very high	77.8	Confident	12 Å²	12	68.5 Å²	68.5	7%	0.073	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	129.3	-170.2	-173.7	0	0	0	0	109.3	P16 V17 I34 Q35 L36 V93 C124 L126	V14-P16 CarbonylContact C-O 3.6Å; V14-P16 CarbonylContact O-C 3.56Å; V14-V17 WeakPolarHBondContact O-CG2 3.34Å; V14-I34 HydrophobicContact CG1-CD1 4.11Å; V14-Q35 WeakPolarHBondContact CA-O 3.44Å; V14-L36 HydrophobicContact CB-CD2 4.45Å; V14-L36 HydrophobicContact CG1-CD2 4.04Å; V14-L36 HydrophobicContact CG2-CD2 3.9Å; V14-V93 HydrophobicContact CG1-CG2 4.29Å; V14-V93 HydrophobicContact CG2-CB 4.37Å; V14-V93 HydrophobicContact CG2-CG2 4.11Å; V14-C124 HydrophobicContact CG2-CB 3.74Å; V14-L126 HydrophobicContact CG1-CD1 3.94Å; V14-L126 HydrophobicContact CG1-CD2 4.08Å; V14-L126 HydrophobicContact CG1-CG 4.43Å
15	Y	96.6	Very high	79.4	Confident	98 Å²	98	65.7 Å²	65.7	38%	0.384	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	129.7	-176.2	-63.5	-81.7	0	0	0	110.7	E13 V17 I34 Q35 M70	E13-Y15 HydrophobicContact CB-CE2 3.89Å; E13-Y15 PolarHBondContact OE2-OH 3.42Å; Y15-V17 HydrophobicContact CD1-CG2 4.17Å; Y15-V17 HydrophobicContact CE1-CG2 4.3Å; Y15-I34 CarbonylContact O-C 3.57Å; Y15-I34 WeakPolarHBondContact O-CA 3.2Å; Y15-Q35 PolarHBondContact N-O 2.99Å; Y15-Q35 PolarHBondContact O-N 3.34Å; Y15-M70 HydrophobicContact CD2-CE 4.23Å; Y15-M70 HydrophobicContact CE2-CE 4.47Å
16	P	95.9	Very high	80.4	Confident	62 Å²	62	64.9 Å²	64.9	40%	0.403	34%	0.343	S	S	.	.	S	Bend	cis	-54.4	153.4	-9.2	25.4	-36.6	0	0	0	113.4	V14 T19	V14-P16 CarbonylContact C-O 3.6Å; V14-P16 CarbonylContact O-C 3.56Å; P16-T19 WeakPolarHBondContact CB-O 3.19Å; P16-T19 WeakPolarHBondContact CG-O 3.41Å
17	V	92.8	Very high	81.7	Confident	92 Å²	92	69 Å²	69	56%	0.558	35%	0.354	S	S	*	.	S	Bend	trans	-79.6	138.8	176.4	-177.3	0	0	0	0	108.3	V14 Y15 T19	V14-V17 WeakPolarHBondContact O-CG2 3.34Å; Y15-V17 HydrophobicContact CD1-CG2 4.17Å; Y15-V17 HydrophobicContact CE1-CG2 4.3Å; V17-T19 PolarHBondContact O-N 3.27Å
18	D	91.7	Very high	83.2	Confident	107 Å²	107	68.9 Å²	68.9	57%	0.572	34%	0.344	S	S	*	.	S	Bend	trans	56	-21.9	173.7	-58.5	-26	0	0	0	119.6	L126 E127	D18-L126 CarbonylContact O-C 3.49Å; D18-L126 WeakPolarHBondContact O-CA 3.23Å; D18-E127 PolarHBondContact O-N 2.67Å
19	T	93.9	Very high	84.8	Confident	18 Å²	18	66.2 Å²	66.2	11%	0.11	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	139.2	-178.8	-59.1	0	0	0	0	113.4	P16 V17 H21 E127 K129	P16-T19 WeakPolarHBondContact CB-O 3.19Å; P16-T19 WeakPolarHBondContact CG-O 3.41Å; V17-T19 PolarHBondContact O-N 3.27Å; T19-H21 VanDerWaalsContact CG2-NE2 3.32Å; T19-H21 WeakPolarHBondContact CG2-NE2 3.24Å; T19-E127 CarbonylContact C-O 3.56Å; T19-E127 WeakPolarHBondContact CA-O 2.99Å; T19-E127 HydrophobicContact CG2-CB 4.5Å; T19-K129 HydrophobicContact CG2-CB 4.08Å; T19-K129 HydrophobicContact CG2-CD 3.85Å; T19-K129 HydrophobicContact CG2-CG 3.69Å; T19-K129 PolarHBondContact OG1-NZ 3.35Å
20	I	93.8	Very high	86.3	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.015	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	127.3	163.5	-54.9	171.3	0	0	0	108	F22 A32 I34 V75 C91 L126 E127 V128 K129	I20-F22 HydrophobicContact CG2-CD2 4.24Å; I20-F22 HydrophobicContact CG2-CE2 3.64Å; I20-F22 HydrophobicContact CG2-CZ 4.02Å; I20-A32 HydrophobicContact CG2-CB 3.57Å; I20-I34 HydrophobicContact CD1-CG2 3.73Å; I20-I34 HydrophobicContact CG1-CG2 3.76Å; I20-V75 HydrophobicContact CD1-CG1 4.37Å; I20-V75 HydrophobicContact CD1-CG2 4.25Å; I20-C91 HydrophobicContact CD1-CB 4.28Å; I20-L126 HydrophobicContact CD1-CB 4.4Å; I20-L126 HydrophobicContact CD1-CD1 3.78Å; I20-L126 HydrophobicContact CG1-CB 4.31Å; I20-L126 HydrophobicContact CG1-CD1 3.93Å; I20-E127 PolarHBondContact N-O 2.92Å; I20-V128 WeakPolarHBondContact O-CA 3.35Å; I20-K129 PolarHBondContact O-N 2.85Å
21	H	91.6	Very high	87.8	Confident	93 Å²	93	64.4 Å²	64.4	43%	0.431	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	142.6	176.7	-70.3	-102.3	0	0	0	111.3	T19 D131	T19-H21 VanDerWaalsContact CG2-NE2 3.32Å; T19-H21 WeakPolarHBondContact CG2-NE2 3.24Å; H21-D131 WeakPolarHBondContact CB-OD2 3.31Å; H21-D131 IonicContact CE1-OD1 3.7Å; H21-D131 IonicContact CE1-OD2 3.42Å; H21-D131 IonicContact CG-OD2 3.04Å; H21-D131 VanDerWaalsContact ND1-CG 3.27Å; H21-D131 IonicContact ND1-OD1 2.66Å; H21-D131 PolarHBondContact ND1-OD1 3.16Å; H21-D131 IonicContact ND1-OD2 3.68Å; H21-D131 PolarHBondContact ND1-OD2 2.94Å
22	F	89.7	Confident	88.6	Confident	9 Å²	9	62.9 Å²	62.9	4%	0.039	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	152.1	171	-72.8	-73.5	0	0	0	108.3	I20 Q30 A32 V75 C77 V128 K129 F130 D131	I20-F22 HydrophobicContact CG2-CD2 4.24Å; I20-F22 HydrophobicContact CG2-CE2 3.64Å; I20-F22 HydrophobicContact CG2-CZ 4.02Å; F22-Q30 HydrophobicContact CD1-CB 3.71Å; F22-Q30 HydrophobicContact CE1-CB 4.2Å; F22-A32 HydrophobicContact CD1-CB 4.29Å; F22-A32 HydrophobicContact CE1-CB 3.59Å; F22-A32 HydrophobicContact CE2-CB 4.44Å; F22-A32 HydrophobicContact CZ-CB 3.67Å; F22-V75 HydrophobicContact CZ-CB 4.32Å; F22-V75 HydrophobicContact CZ-CG1 3.98Å; F22-C77 HydrophobicContact CD1-CB 3.81Å; F22-C77 HydrophobicContact CD2-CB 4.15Å; F22-C77 HydrophobicContact CE1-CB 3.56Å; F22-C77 HydrophobicContact CE2-CB 3.93Å; F22-C77 HydrophobicContact CG-CB 4.1Å; F22-C77 HydrophobicContact CZ-CB 3.64Å; F22-V128 HydrophobicContact CD2-CG1 3.62Å; F22-V128 HydrophobicContact CE2-CG1 3.79Å; F22-K129 PolarHBondContact N-O 2.82Å; F22-F130 HydrophobicContact CB-CD1 3.87Å; F22-F130 HydrophobicContact CB-CE1 3.94Å; F22-F130 HydrophobicContact CD2-CE1 4.47Å; F22-F130 HydrophobicContact CG-CE1 4.43Å; F22-F130 CarbonylContact O-C 3.58Å; F22-F130 VanDerWaalsContact O-CA 3.31Å; F22-F130 WeakPolarHBondContact O-CA 3.29Å; F22-D131 PolarHBondContact O-N 3.24Å
23	S	84.4	Confident	88.7	Confident	37 Å²	37	65 Å²	65	26%	0.259	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	164.6	169.8	-71.5	0	0	0	0	111.5	Q30 D131 D133	S23-Q30 PolarHBondContact O-NE2 2.75Å; S23-Q30 PolarHBondContact O-OE1 3.22Å; S23-D131 CarbonylContact C-O 3.49Å; S23-D133 WeakPolarHBondContact CB-OD1 3.23Å; S23-D133 VanDerWaalsContact CB-OD2 3.29Å; S23-D133 WeakPolarHBondContact CB-OD2 3.09Å; S23-D133 PolarHBondContact OG-OD1 3.3Å
24	R	78.4	Confident	88.9	Confident	79 Å²	79	62.6 Å²	62.6	30%	0.298	33%	0.334	S	S	.	.			trans	-94.6	8.9	171.7	-159.9	-179.2	-83.2	-133.3	-3.4	112.7	I26 P81 D131 D133	R24-I26 PolarHBondContact O-N 3Å; R24-P81 HydrophobicContact CG-CB 3.67Å; R24-P81 HydrophobicContact CG-CG 4.06Å; R24-D131 WeakPolarHBondContact CB-O 3.37Å; R24-D131 PolarHBondContact N-O 3.39Å; R24-D133 PolarHBondContact N-OD2 2.86Å
25	I	76	Confident	88.9	Confident	81 Å²	81	66.1 Å²	66.1	42%	0.415	35%	0.349	S	S	.	.			trans	-56.8	124.1	177.5	-52.6	166.7	0	0	0	111.2	L28 Q30 D133	I25-L28 HydrophobicContact CG2-CB 4.22Å; I25-L28 HydrophobicContact CG2-CD1 3.61Å; I25-L28 HydrophobicContact CG2-CG 4.42Å; I25-Q30 PolarHBondContact O-NE2 3.22Å; I25-D133 PolarHBondContact N-OD2 2.97Å
26	I	69.4	Low	89	Confident	99 Å²	99	61.4 Å²	61.4	51%	0.508	33%	0.331	S	S	.	.	S	Bend	trans	-72.9	153.4	179.7	-57.4	164.8	0	0	0	110.3	R24 L28 L80 P81	R24-I26 PolarHBondContact O-N 3Å; I26-L28 PolarHBondContact O-N 3.46Å; I26-L80 HydrophobicContact CG2-CD2 4.44Å; I26-P81 HydrophobicContact CG1-CG 3.6Å
27	D	70.6	Confident	89	Confident	135 Å²	135	61.1 Å²	61.1	72%	0.722	32%	0.322	S	S	*	.	S	Bend	trans	57.5	-4.7	175.3	-67.5	-38.8	0	0	0	118.1	L80	D27-L80 WeakPolarHBondContact OD1-CD2 3.22Å
28	L	81.9	Confident	89.2	Confident	111 Å²	111	56.8 Å²	56.8	58%	0.581	30%	0.296	S	S	*	.			trans	-95.9	135.5	-179.4	-85	161.8	0	0	0	113	I25 I26 Q30	I25-L28 HydrophobicContact CG2-CB 4.22Å; I25-L28 HydrophobicContact CG2-CD1 3.61Å; I25-L28 HydrophobicContact CG2-CG 4.42Å; I26-L28 PolarHBondContact O-N 3.46Å; L28-Q30 PolarHBondContact O-N 2.77Å
29	T	89.5	Confident	89.2	Confident	66 Å²	66	54.8 Å²	54.8	41%	0.405	29%	0.285	S	S	.	.			trans	-71.8	120.3	168.5	-76.8	0	0	0	0	109.4	R76 T78	T29-R76 HydrophobicContact CG2-CG 3.72Å; T29-R76 PolarHBondContact OG1-NH2 3.46Å; T29-T78 HydrophobicContact CG2-CG2 4.35Å
30	Q	91	Very high	89.2	Confident	24 Å²	24	54.6 Å²	54.6	11%	0.112	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	150.9	-178	-53.2	-171.7	26.8	0	0	111.7	F22 S23 I25 L28 R76 C77	F22-Q30 HydrophobicContact CD1-CB 3.71Å; F22-Q30 HydrophobicContact CE1-CB 4.2Å; S23-Q30 PolarHBondContact O-NE2 2.75Å; S23-Q30 PolarHBondContact O-OE1 3.22Å; I25-Q30 PolarHBondContact O-NE2 3.22Å; L28-Q30 PolarHBondContact O-N 2.77Å; Q30-R76 WeakPolarHBondContact O-CA 3.42Å; Q30-C77 PolarHBondContact N-O 3.11Å; Q30-C77 PolarHBondContact O-N 3.16Å
31	L	93.7	Very high	89.1	Confident	126 Å²	126	59.8 Å²	59.8	66%	0.66	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.5	111.6	-177.3	-65.6	177.6	0	0	0	110.8	R76	L31-R76 HydrophobicContact CD2-CB 3.93Å; L31-R76 HydrophobicContact CD2-CG 4.11Å
32	A	94.7	Very high	89.1	Confident	19 Å²	19	58 Å²	58	16%	0.157	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	173.4	164.4	0	0	0	0	0	109.9	I20 F22 V75	I20-A32 HydrophobicContact CG2-CB 3.57Å; F22-A32 HydrophobicContact CD1-CB 4.29Å; F22-A32 HydrophobicContact CE1-CB 3.59Å; F22-A32 HydrophobicContact CE2-CB 4.44Å; F22-A32 HydrophobicContact CZ-CB 3.67Å; A32-V75 HydrophobicContact CB-CB 4.42Å; A32-V75 PolarHBondContact N-O 2.9Å; A32-V75 PolarHBondContact O-N 2.94Å
33	S	96.4	Very high	89.3	Confident	43 Å²	43	63.2 Å²	63.2	30%	0.301	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	136.2	169.7	66.2	0	0	0	0	112.2	K72 I73	S33-K72 WeakPolarHBondContact OG-CE 3.49Å; S33-I73 VanDerWaalsContact CA-O 3.24Å; S33-I73 WeakPolarHBondContact CA-O 3.24Å; S33-I73 WeakPolarHBondContact CB-O 3.23Å
34	I	97.3	Very high	89.7	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	160.2	168	71.2	174.1	0	0	0	109.9	V14 Y15 I20 L36 L48 I73 V75 V93 L126	V14-I34 HydrophobicContact CG1-CD1 4.11Å; Y15-I34 CarbonylContact O-C 3.57Å; Y15-I34 WeakPolarHBondContact O-CA 3.2Å; I20-I34 HydrophobicContact CD1-CG2 3.73Å; I20-I34 HydrophobicContact CG1-CG2 3.76Å; I34-L36 HydrophobicContact CD1-CD2 3.93Å; I34-L36 HydrophobicContact CG1-CD2 4.39Å; I34-L48 HydrophobicContact CD1-CD2 3.85Å; I34-I73 HydrophobicContact CG1-CB 3.91Å; I34-I73 HydrophobicContact CG1-CG1 4.27Å; I34-I73 PolarHBondContact N-O 2.76Å; I34-I73 PolarHBondContact O-N 3.12Å; I34-V75 HydrophobicContact CG1-CG2 4.45Å; I34-V75 HydrophobicContact CG2-CG2 4.25Å; I34-V93 HydrophobicContact CD1-CG2 4Å; I34-L126 HydrophobicContact CD1-CD1 3.92Å; I34-L126 HydrophobicContact CG2-CD1 4.08Å
35	Q	97.8	Very high	90.4	Very high	85 Å²	85	57.7 Å²	57.7	40%	0.397	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133.1	172.5	-40.5	-169.2	40.6	0	0	109	V14 Y15 M70 K71	V14-Q35 WeakPolarHBondContact CA-O 3.44Å; Y15-Q35 PolarHBondContact N-O 2.99Å; Y15-Q35 PolarHBondContact O-N 3.34Å; Q35-M70 HydrophobicContact CB-CE 4.4Å; Q35-M70 HydrophobicContact CB-CG 4.02Å; Q35-M70 HydrophobicContact CB-SD 3.43Å; Q35-M70 WeakPolarHBondContact CB-SD 3.26Å; Q35-K71 WeakPolarHBondContact CA-O 3.32Å
36	L	97.7	Very high	91.4	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	118.2	175.3	-51.1	-177.7	0	0	0	108.7	V12 E13 V14 I34 Y46 L65 M70 K71 I73 V93	V12-L36 HydrophobicContact CG2-CB 4.45Å; E13-L36 WeakPolarHBondContact O-CA 3.35Å; V14-L36 HydrophobicContact CB-CD2 4.45Å; V14-L36 HydrophobicContact CG1-CD2 4.04Å; V14-L36 HydrophobicContact CG2-CD2 3.9Å; I34-L36 HydrophobicContact CD1-CD2 3.93Å; I34-L36 HydrophobicContact CG1-CD2 4.39Å; L36-Y46 HydrophobicContact CD1-CD1 4.3Å; L36-Y46 HydrophobicContact CD1-CD2 3.52Å; L36-Y46 HydrophobicContact CD1-CE2 3.88Å; L36-Y46 HydrophobicContact CD1-CG 3.76Å; L36-L65 HydrophobicContact CB-CD1 3.86Å; L36-L65 HydrophobicContact CB-CD2 4.14Å; L36-M70 VanDerWaalsContact C-SD 3.59Å; L36-M70 CarbonylContact O-C 3.57Å; L36-M70 WeakPolarHBondContact O-CA 3.32Å; L36-K71 PolarHBondContact N-O 2.85Å; L36-K71 PolarHBondContact O-N 3.05Å; L36-I73 HydrophobicContact CD1-CD1 4.14Å; L36-I73 HydrophobicContact CD1-CG1 3.9Å; L36-I73 HydrophobicContact CG-CG1 3.91Å; L36-V93 HydrophobicContact CD1-CG1 4.21Å; L36-V93 HydrophobicContact CD2-CG1 4Å; L36-V93 HydrophobicContact CD2-CG2 3.79Å
37	Y	96.9	Very high	92.6	Very high	56 Å²	56	51.4 Å²	51.4	22%	0.22	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133.1	174.7	-178.6	-133.2	0	0	0	109.9	V12 E13 N39 M70	V12-Y37 CarbonylContact C-O 3.49Å; V12-Y37 VanDerWaalsContact CA-O 3.32Å; V12-Y37 WeakPolarHBondContact CA-O 3.4Å; V12-Y37 WeakPolarHBondContact CG2-O 3.34Å; E13-Y37 PolarHBondContact N-O 2.79Å; E13-Y37 PolarHBondContact O-N 2.83Å; E13-Y37 WeakPolarHBondContact OE2-CD1 3.37Å; Y37-N39 HydrophobicContact CD1-CB 3.8Å; Y37-N39 HydrophobicContact CE1-CB 3.46Å; Y37-N39 VanDerWaalsContact CE1-CB 3.46Å; Y37-N39 WeakPolarHBondContact CE1-OD1 3.49Å; Y37-N39 PolarHBondContact OH-OD1 2.91Å; Y37-M70 HydrophobicContact CD2-CE 4.43Å; Y37-M70 HydrophobicContact CG-CE 4.21Å
38	N	95.8	Very high	93.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	99.7	169.9	177.8	5.1	0	0	0	109.3	S40 E42 I44 L65 Q66 F68 R69	N38-S40 PolarHBondContact O-N 3.08Å; N38-S40 WeakPolarHBondContact OD1-CB 3.45Å; N38-S40 PolarHBondContact OD1-N 2.82Å; N38-S40 VanDerWaalsContact OD1-N 3.16Å; N38-S40 PolarHBondContact OD1-OG 3.06Å; N38-E42 PolarHBondContact ND2-O 3.28Å; N38-I44 HydrophobicContact CB-CD1 4.39Å; N38-I44 VanDerWaalsContact OD1-CD1 3.23Å; N38-I44 WeakPolarHBondContact OD1-CD1 3.38Å; N38-L65 HydrophobicContact CB-CB 3.77Å; N38-L65 HydrophobicContact CB-CD1 4.14Å; N38-L65 PolarHBondContact ND2-O 3.08Å; N38-Q66 WeakPolarHBondContact CB-O 3.35Å; N38-Q66 PolarHBondContact ND2-O 2.81Å; N38-F68 WeakPolarHBondContact O-CA 3.3Å; N38-F68 PolarHBondContact O-N 3.13Å; N38-R69 PolarHBondContact N-O 3.24Å; N38-R69 VanDerWaalsContact N-O 3.08Å
39	N	93.5	Very high	94.5	Very high	66 Å²	66	46.2 Å²	46.2	35%	0.353	23%	0.231	S	C	.	.			trans	-90.6	41.3	179.9	-154.6	9.1	0	0	0	111.6	T11 E13 Y37	T11-N39 PolarHBondContact O-N 2.66Å; T11-N39 PolarHBondContact OG1-O 2.97Å; E13-N39 WeakPolarHBondContact OE1-CB 3.43Å; E13-N39 PolarHBondContact OE1-ND2 2.91Å; Y37-N39 HydrophobicContact CD1-CB 3.8Å; Y37-N39 HydrophobicContact CE1-CB 3.46Å; Y37-N39 VanDerWaalsContact CE1-CB 3.46Å; Y37-N39 WeakPolarHBondContact CE1-OD1 3.49Å; Y37-N39 PolarHBondContact OH-OD1 2.91Å
40	S	92.4	Very high	94.8	Very high	13 Å²	13	44.6 Å²	44.6	9%	0.091	22%	0.221	C	C	.	.	S	Bend	trans	-139.9	164.7	-179	83.3	0	0	0	0	111.9	N38 E42 P67	N38-S40 PolarHBondContact O-N 3.08Å; N38-S40 WeakPolarHBondContact OD1-CB 3.45Å; N38-S40 PolarHBondContact OD1-N 2.82Å; N38-S40 VanDerWaalsContact OD1-N 3.16Å; N38-S40 PolarHBondContact OD1-OG 3.06Å; S40-E42 VanDerWaalsContact C-N 3.3Å; S40-E42 PolarHBondContact OG-N 3.32Å; S40-E42 PolarHBondContact OG-O 3.31Å; S40-P67 WeakPolarHBondContact O-CA 3.45Å; S40-P67 WeakPolarHBondContact O-CB 3.21Å
41	T	92.5	Very high	95	Very high	112 Å²	112	46.9 Å²	46.9	69%	0.687	24%	0.236	S	C	*	.	S	Bend	trans	-78.4	-10.8	174.7	47.4	0	0	0	0	113.7	P67 F68	T41-P67 WeakPolarHBondContact O-CG 3.42Å; T41-F68 HydrophobicContact CG2-CE2 3.96Å; T41-F68 HydrophobicContact CG2-CZ 3.76Å
42	E	91.8	Very high	94.9	Very high	56 Å²	56	41 Å²	41	26%	0.262	21%	0.205	S	C	.	.	S	Bend	trans	-97.4	157.4	-175.1	-56.7	-174.2	100	0	0	111.2	R8 N38 S40 V97	R8-E42 IonicContact CZ-OE1 3.65Å; R8-E42 IonicContact NH1-OE1 3.12Å; R8-E42 PolarHBondContact NH1-OE1 3.34Å; N38-E42 PolarHBondContact ND2-O 3.28Å; S40-E42 VanDerWaalsContact C-N 3.3Å; S40-E42 PolarHBondContact OG-N 3.32Å; S40-E42 PolarHBondContact OG-O 3.31Å; E42-V97 HydrophobicContact CB-CG1 3.91Å; E42-V97 VanDerWaalsContact CD-CG1 3.46Å; E42-V97 HydrophobicContact CG-CG1 4.29Å; E42-V97 WeakPolarHBondContact OE1-CG1 3.39Å
43	W	92.8	Very high	94.9	Very high	118 Å²	118	44.1 Å²	44.1	45%	0.447	23%	0.225	S	C	.	.			trans	-76.7	135.1	169.4	-79.3	75.6	0	0	0	109.7	F64 Q66 L98	W43-F64 HydrophobicContact CE3-CB 4.03Å; W43-F64 HydrophobicContact CZ3-CB 4.18Å; W43-Q66 HydrophobicContact CD2-CG 4.34Å; W43-Q66 HydrophobicContact CE3-CG 4.07Å; W43-Q66 HydrophobicContact CH2-CG 3.34Å; W43-Q66 HydrophobicContact CZ2-CG 3.59Å; W43-Q66 HydrophobicContact CZ3-CG 3.58Å; W43-L98 HydrophobicContact CB-CB 3.97Å; W43-L98 HydrophobicContact CB-CD2 4.05Å; W43-L98 WeakPolarHBondContact O-CB 3.41Å; W43-L98 PolarHBondContact O-N 3.29Å
44	I	93.2	Very high	94.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.6	179.3	-66.6	-177.6	0	0	0	110.1	V12 N38 F64 L65 A95	V12-I44 HydrophobicContact CB-CD1 4.21Å; N38-I44 HydrophobicContact CB-CD1 4.39Å; N38-I44 VanDerWaalsContact OD1-CD1 3.23Å; N38-I44 WeakPolarHBondContact OD1-CD1 3.38Å; I44-F64 CarbonylContact O-C 3.55Å; I44-F64 WeakPolarHBondContact O-CA 3.18Å; I44-L65 HydrophobicContact CB-CB 4.41Å; I44-L65 PolarHBondContact N-O 3Å; I44-L65 PolarHBondContact O-N 2.77Å; I44-A95 HydrophobicContact CG2-CB 3.79Å
45	A	94.4	Very high	94.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	137.8	163.9	0	0	0	0	0	109.9	F64 A95 H96 Y110 W111	A45-F64 HydrophobicContact CB-CD1 3.79Å; A45-F64 HydrophobicContact CB-CE1 3.81Å; A45-A95 VanDerWaalsContact O-CA 3.32Å; A45-A95 WeakPolarHBondContact O-CA 3.34Å; A45-H96 PolarHBondContact N-O 2.94Å; A45-H96 PolarHBondContact O-N 3.02Å; A45-Y110 HydrophobicContact CB-CD1 3.82Å; A45-Y110 HydrophobicContact CB-CE1 3.31Å; A45-W111 HydrophobicContact CB-CZ2 4.03Å
46	Y	95.2	Very high	94.3	Very high	4 Å²	4	44 Å²	44	2%	0.016	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	148.3	176.2	69.2	-87.4	0	0	0	112.6	L36 L48 P60 Y62 G63 L65 I73 V94 W111	L36-Y46 HydrophobicContact CD1-CD1 4.3Å; L36-Y46 HydrophobicContact CD1-CD2 3.52Å; L36-Y46 HydrophobicContact CD1-CE2 3.88Å; L36-Y46 HydrophobicContact CD1-CG 3.76Å; Y46-L48 HydrophobicContact CD2-CD1 3.67Å; Y46-L48 HydrophobicContact CE2-CD1 3.81Å; Y46-P60 WeakPolarHBondContact OH-CG 2.93Å; Y46-Y62 CarbonylContact O-C 3.41Å; Y46-Y62 VanDerWaalsContact O-CA 3.25Å; Y46-Y62 WeakPolarHBondContact O-CA 3.43Å; Y46-G63 VanDerWaalsContact CD1-C 3.41Å; Y46-G63 VanDerWaalsContact CD1-O 3.26Å; Y46-G63 WeakPolarHBondContact CD1-O 3.47Å; Y46-G63 VanDerWaalsContact CE1-CA 3.46Å; Y46-G63 PolarHBondContact N-O 2.87Å; Y46-G63 PolarHBondContact O-N 2.87Å; Y46-L65 HydrophobicContact CD1-CD1 4.36Å; Y46-L65 HydrophobicContact CD1-CD2 3.93Å; Y46-L65 HydrophobicContact CD1-CG 3.71Å; Y46-L65 HydrophobicContact CE1-CD2 3.7Å; Y46-L65 HydrophobicContact CE1-CG 3.98Å; Y46-I73 HydrophobicContact CE2-CD1 3.71Å; Y46-V94 CarbonylContact C-O 3.59Å; Y46-V94 VanDerWaalsContact CA-O 3.31Å; Y46-V94 WeakPolarHBondContact CA-O 3.41Å; Y46-W111 VanDerWaalsContact C-NE1 3.25Å; Y46-W111 PolarHBondContact O-NE1 2.98Å
47	K	95.5	Very high	94.2	Very high	45 Å²	45	49 Å²	49	20%	0.196	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	124.5	174.4	174.6	170	-179	173.3	0	109.4	V94 W111	K47-V94 PolarHBondContact N-O 3.49Å; K47-V94 WeakPolarHBondContact O-CB 3.35Å; K47-V94 PolarHBondContact O-N 3.04Å; K47-W111 HydrophobicContact CB-CD2 3.77Å; K47-W111 VanDerWaalsContact CB-CE2 3.49Å; K47-W111 HydrophobicContact CB-CE3 4.34Å; K47-W111 HydrophobicContact CB-CG 4.11Å; K47-W111 HydrophobicContact CB-CH2 4.4Å; K47-W111 HydrophobicContact CB-CZ2 3.83Å; K47-W111 HydrophobicContact CD-CB 4.12Å; K47-W111 HydrophobicContact CD-CD2 3.89Å; K47-W111 HydrophobicContact CD-CE3 4.07Å; K47-W111 HydrophobicContact CD-CG 3.92Å; K47-W111 HydrophobicContact CG-CD2 4.5Å
48	L	96.9	Very high	94.3	Very high	15 Å²	15	48 Å²	48	8%	0.079	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	143.1	176.1	-63	92.6	0	0	0	110	I34 Y46 F58 G61 I73 T92 V93	I34-L48 HydrophobicContact CD1-CD2 3.85Å; Y46-L48 HydrophobicContact CD2-CD1 3.67Å; Y46-L48 HydrophobicContact CE2-CD1 3.81Å; L48-F58 HydrophobicContact CB-CB 4.23Å; L48-F58 HydrophobicContact CB-CD1 4.08Å; L48-F58 HydrophobicContact CB-CD2 3.47Å; L48-F58 VanDerWaalsContact CB-CD2 3.47Å; L48-F58 HydrophobicContact CB-CE1 4.28Å; L48-F58 HydrophobicContact CB-CE2 3.71Å; L48-F58 HydrophobicContact CB-CG 3.66Å; L48-F58 HydrophobicContact CB-CZ 4.1Å; L48-F58 HydrophobicContact CD2-CB 4.24Å; L48-F58 HydrophobicContact CD2-CD1 3.49Å; L48-F58 VanDerWaalsContact CD2-CD1 3.49Å; L48-F58 HydrophobicContact CD2-CD2 4.44Å; L48-F58 HydrophobicContact CD2-CE1 3.85Å; L48-F58 HydrophobicContact CD2-CG 3.81Å; L48-F58 HydrophobicContact CD2-CZ 4.46Å; L48-F58 HydrophobicContact CG-CD1 4.39Å; L48-F58 HydrophobicContact CG-CG 4.27Å; L48-G61 WeakPolarHBondContact CD1-O 3.47Å; L48-G61 PolarHBondContact N-O 2.93Å; L48-I73 HydrophobicContact CD1-CG2 4.31Å; L48-I73 HydrophobicContact CD2-CG2 3.94Å; L48-T92 WeakPolarHBondContact CA-O 3.48Å; L48-V93 HydrophobicContact CD2-CG2 4.46Å
49	R	95.9	Very high	94.3	Very high	122 Å²	122	57.7 Å²	57.7	46%	0.46	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	158.1	174.8	-55.4	-171.7	-171.5	-158.6	5.3	109.4	F58 C91 T92 V94	R49-F58 WeakPolarHBondContact O-CZ 3.31Å; R49-C91 CarbonylContact O-C 3.55Å; R49-C91 WeakPolarHBondContact O-CA 3.49Å; R49-T92 PolarHBondContact N-O 2.72Å; R49-T92 PolarHBondContact O-N 3.12Å; R49-V94 HydrophobicContact CG-CG2 4.26Å
50	T	96	Very high	94.5	Very high	32 Å²	32	56.9 Å²	56.9	20%	0.196	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	151.2	176.1	175.7	0	0	0	0	109.9	S52 P53 I56 F58 R90	T50-S52 VanDerWaalsContact C-N 3.29Å; T50-S52 PolarHBondContact OG1-N 3.01Å; T50-S52 VanDerWaalsContact OG1-N 3.08Å; T50-P53 HydrophobicContact CG2-CB 4.1Å; T50-I56 HydrophobicContact CG2-CB 4.22Å; T50-I56 HydrophobicContact CG2-CG2 4.43Å; T50-F58 HydrophobicContact CG2-CE2 3.95Å; T50-F58 HydrophobicContact CG2-CZ 4.42Å; T50-R90 WeakPolarHBondContact CA-O 3.25Å
51	T	94.2	Very high	94.7	Very high	71 Å²	71	57.2 Å²	57.2	44%	0.436	29%	0.289	S	S	.	.	S	Bend	trans	-70.4	-22.6	167.9	42.2	0	0	0	0	113.4	P53 E89 R90	T51-P53 VanDerWaalsContact C-CD 3.49Å; T51-P53 VanDerWaalsContact O-CD 3.31Å; T51-P53 WeakPolarHBondContact O-CD 3.38Å; T51-E89 VanDerWaalsContact CB-OE2 3.26Å; T51-E89 WeakPolarHBondContact CB-OE2 3.39Å; T51-E89 PolarHBondContact OG1-OE2 2.89Å; T51-R90 HydrophobicContact CG2-CB 4.13Å; T51-R90 PolarHBondContact N-O 3.01Å; T51-R90 PolarHBondContact OG1-N 2.87Å; T51-R90 PolarHBondContact OG1-O 3.03Å
52	S	92.5	Very high	94.9	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.014	28%	0.276	C	S	.	.			trans	-120.8	74.4	-178.9	-119.1	0	0	0	0	111.2	T50 A54 E55 I56 E89	T50-S52 VanDerWaalsContact C-N 3.29Å; T50-S52 PolarHBondContact OG1-N 3.01Å; T50-S52 VanDerWaalsContact OG1-N 3.08Å; S52-A54 VanDerWaalsContact C-N 3.27Å; S52-A54 PolarHBondContact O-N 2.92Å; S52-E55 VanDerWaalsContact C-OE2 3.23Å; S52-E55 VanDerWaalsContact CA-OE2 3.3Å; S52-E55 WeakPolarHBondContact CA-OE2 3.41Å; S52-E55 WeakPolarHBondContact CB-OE2 3.46Å; S52-E55 PolarHBondContact O-N 2.77Å; S52-E55 VanDerWaalsContact OG-CD 3.28Å; S52-E55 PolarHBondContact OG-OE2 2.88Å; S52-I56 WeakPolarHBondContact O-CB 3.28Å; S52-I56 PolarHBondContact O-N 2.8Å; S52-E89 VanDerWaalsContact CB-OE2 3.29Å; S52-E89 WeakPolarHBondContact CB-OE2 3.48Å; S52-E89 PolarHBondContact N-OE2 2.9Å; S52-E89 PolarHBondContact OG-OE1 2.8Å
53	P	94.9	Very high	95.1	Very high	86 Å²	86	54.7 Å²	54.7	56%	0.558	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-7.3	-173.8	32.3	-37.4	0	0	0	114.1	T50 T51 K57	T50-P53 HydrophobicContact CG2-CB 4.1Å; T51-P53 VanDerWaalsContact C-CD 3.49Å; T51-P53 VanDerWaalsContact O-CD 3.31Å; T51-P53 WeakPolarHBondContact O-CD 3.38Å; P53-K57 PolarHBondContact O-NZ 2.83Å
54	A	92	Very high	95.2	Very high	63 Å²	63	51.2 Å²	51.2	52%	0.521	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-44.1	171.4	0	0	0	0	0	110.6	S52 K57	S52-A54 VanDerWaalsContact C-N 3.27Å; S52-A54 PolarHBondContact O-N 2.92Å; A54-K57 WeakPolarHBondContact O-CE 3.43Å; A54-K57 PolarHBondContact O-NZ 2.97Å
55	E	91.2	Very high	95.3	Very high	59 Å²	59	51.4 Å²	51.4	28%	0.276	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-34.7	-172	-52.4	71.8	-160.9	0	0	112.9	S52 C77 T78 R79	S52-E55 VanDerWaalsContact C-OE2 3.23Å; S52-E55 VanDerWaalsContact CA-OE2 3.3Å; S52-E55 WeakPolarHBondContact CA-OE2 3.41Å; S52-E55 WeakPolarHBondContact CB-OE2 3.46Å; S52-E55 PolarHBondContact O-N 2.77Å; S52-E55 VanDerWaalsContact OG-CD 3.28Å; S52-E55 PolarHBondContact OG-OE2 2.88Å; E55-C77 CarbonylContact O-C 3.57Å; E55-C77 WeakPolarHBondContact O-CA 3.32Å; E55-T78 PolarHBondContact O-N 2.9Å; E55-T78 PolarHBondContact O-OG1 2.91Å; E55-R79 HydrophobicContact CB-CB 4.14Å; E55-R79 HydrophobicContact CG-CB 4.28Å
56	I	94.4	Very high	95.3	Very high	4 Å²	4	55.9 Å²	55.9	2%	0.021	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	121.6	-175.8	-59.5	173.8	0	0	0	110	T50 S52 F58 V75 R76 E89 V128	T50-I56 HydrophobicContact CG2-CB 4.22Å; T50-I56 HydrophobicContact CG2-CG2 4.43Å; S52-I56 WeakPolarHBondContact O-CB 3.28Å; S52-I56 PolarHBondContact O-N 2.8Å; I56-F58 HydrophobicContact CG2-CE1 4.13Å; I56-F58 HydrophobicContact CG2-CZ 4.01Å; I56-V75 HydrophobicContact CG2-CG1 3.94Å; I56-R76 WeakPolarHBondContact CA-O 3.39Å; I56-E89 HydrophobicContact CD1-CB 4.42Å; I56-V128 HydrophobicContact CD1-CG1 4.29Å; I56-V128 HydrophobicContact CD1-CG2 4.21Å
57	K	96.7	Very high	95.2	Very high	105 Å²	105	57.3 Å²	57.3	46%	0.457	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	136.6	178.9	-49.8	-65.1	-174.6	-172.8	0	111.2	P53 A54 R76	P53-K57 PolarHBondContact O-NZ 2.83Å; A54-K57 WeakPolarHBondContact O-CE 3.43Å; A54-K57 PolarHBondContact O-NZ 2.97Å; K57-R76 HydrophobicContact CB-CB 4.36Å; K57-R76 PolarHBondContact N-O 2.96Å; K57-R76 PolarHBondContact O-N 2.74Å
58	F	97.7	Very high	95.2	Very high	35 Å²	35	60.4 Å²	60.4	15%	0.154	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	139.5	177.9	-53.2	-71.3	0	0	0	111.5	L48 R49 T50 I56 G61 I73 L74 V75 C91	L48-F58 HydrophobicContact CB-CB 4.23Å; L48-F58 HydrophobicContact CB-CD1 4.08Å; L48-F58 HydrophobicContact CB-CD2 3.47Å; L48-F58 VanDerWaalsContact CB-CD2 3.47Å; L48-F58 HydrophobicContact CB-CE1 4.28Å; L48-F58 HydrophobicContact CB-CE2 3.71Å; L48-F58 HydrophobicContact CB-CG 3.66Å; L48-F58 HydrophobicContact CB-CZ 4.1Å; L48-F58 HydrophobicContact CD2-CB 4.24Å; L48-F58 HydrophobicContact CD2-CD1 3.49Å; L48-F58 VanDerWaalsContact CD2-CD1 3.49Å; L48-F58 HydrophobicContact CD2-CD2 4.44Å; L48-F58 HydrophobicContact CD2-CE1 3.85Å; L48-F58 HydrophobicContact CD2-CG 3.81Å; L48-F58 HydrophobicContact CD2-CZ 4.46Å; L48-F58 HydrophobicContact CG-CD1 4.39Å; L48-F58 HydrophobicContact CG-CG 4.27Å; R49-F58 WeakPolarHBondContact O-CZ 3.31Å; T50-F58 HydrophobicContact CG2-CE2 3.95Å; T50-F58 HydrophobicContact CG2-CZ 4.42Å; I56-F58 HydrophobicContact CG2-CE1 4.13Å; I56-F58 HydrophobicContact CG2-CZ 4.01Å; F58-G61 PolarHBondContact O-N 2.89Å; F58-I73 HydrophobicContact CB-CG2 4.37Å; F58-L74 CarbonylContact C-O 3.53Å; F58-L74 WeakPolarHBondContact CA-O 3.32Å; F58-V75 HydrophobicContact CD1-CB 4.47Å; F58-V75 HydrophobicContact CD1-CG1 3.96Å; F58-V75 HydrophobicContact CD1-CG2 4.08Å; F58-V75 HydrophobicContact CE1-CG1 3.84Å; F58-V75 HydrophobicContact CE1-CG2 4.34Å; F58-C91 HydrophobicContact CE1-CB 4.29Å; F58-C91 HydrophobicContact CZ-CB 3.99Å; F58-C91 VanDerWaalsContact CZ-SG 3.58Å
59	R	97.4	Very high	95.3	Very high	203 Å²	203	67.1 Å²	67.1	77%	0.766	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.9	111.6	173.8	-157	173.6	-169.7	172.3	3	111.6	L74	R59-L74 PolarHBondContact N-O 2.66Å; R59-L74 PolarHBondContact O-N 3.31Å
60	P	97.1	Very high	95.3	Very high	49 Å²	49	65.4 Å²	65.4	32%	0.318	32%	0.324	S	S	.	.	S	Bend	cis	-70	147.6	-11.4	32.1	-36.2	0	0	0	112.2	Y46 I73	Y46-P60 WeakPolarHBondContact OH-CG 2.93Å; P60-I73 HydrophobicContact CG-CD1 3.79Å; P60-I73 WeakPolarHBondContact O-CG2 3.32Å
61	G	96.7	Very high	95.4	Very high	20 Å²	20	68.5 Å²	68.5	21%	0.206	34%	0.335	C	S	.	.	S	Bend	trans	-84.7	-10.1	176.4	0	0	0	0	0	115.1	L48 F58	L48-G61 WeakPolarHBondContact CD1-O 3.47Å; L48-G61 PolarHBondContact N-O 2.93Å; F58-G61 PolarHBondContact O-N 2.89Å
62	Y	95.5	Very high	95.6	Very high	106 Å²	106	71.1 Å²	71.1	42%	0.416	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	156.7	178.3	48.4	-101.2	0	0	0	109.5	Y46 A107 Y108	Y46-Y62 CarbonylContact O-C 3.41Å; Y46-Y62 VanDerWaalsContact O-CA 3.25Å; Y46-Y62 WeakPolarHBondContact O-CA 3.43Å; Y62-A107 HydrophobicContact CD2-CB 3.84Å; Y62-Y108 AromaticContact CE1-CD2 3.99Å; Y62-Y108 HydrophobicContact CE1-CD2 3.99Å; Y62-Y108 AromaticContact CZ-CD2 3.97Å
63	G	96.1	Very high	95.8	Very high	9 Å²	9	71 Å²	71	9%	0.093	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.4	-164.9	179	0	0	0	0	0	113.3	Y46 A107	Y46-G63 VanDerWaalsContact CD1-C 3.41Å; Y46-G63 VanDerWaalsContact CD1-O 3.26Å; Y46-G63 WeakPolarHBondContact CD1-O 3.47Å; Y46-G63 VanDerWaalsContact CE1-CA 3.46Å; Y46-G63 PolarHBondContact N-O 2.87Å; Y46-G63 PolarHBondContact O-N 2.87Å; G63-A107 VanDerWaalsContact CA-CB 3.45Å
64	F	95.1	Very high	96	Very high	46 Å²	46	71 Å²	71	20%	0.202	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	147.8	171.5	-52.4	-68.4	0	0	0	110.7	W43 I44 A45 L98 A104 A107 Y110	W43-F64 HydrophobicContact CE3-CB 4.03Å; W43-F64 HydrophobicContact CZ3-CB 4.18Å; I44-F64 CarbonylContact O-C 3.55Å; I44-F64 WeakPolarHBondContact O-CA 3.18Å; A45-F64 HydrophobicContact CB-CD1 3.79Å; A45-F64 HydrophobicContact CB-CE1 3.81Å; F64-L98 HydrophobicContact CE1-CD1 4.4Å; F64-A104 HydrophobicContact CE1-CB 3.83Å; F64-A104 HydrophobicContact CE2-CB 3.82Å; F64-A104 VanDerWaalsContact CE2-O 3.32Å; F64-A104 WeakPolarHBondContact CE2-O 3.06Å; F64-A104 HydrophobicContact CZ-CB 3.29Å; F64-A107 HydrophobicContact CD2-CB 4.19Å; F64-A107 HydrophobicContact CE1-CB 4.26Å; F64-A107 HydrophobicContact CE2-CB 3.64Å; F64-A107 VanDerWaalsContact CZ-CA 3.45Å; F64-A107 HydrophobicContact CZ-CB 3.66Å; F64-Y110 HydrophobicContact CE1-CD1 4.08Å; F64-Y110 HydrophobicContact CE1-CG 4.09Å; F64-Y110 HydrophobicContact CZ-CG 4.24Å
65	L	95.3	Very high	96.2	Very high	4 Å²	4	68 Å²	68	2%	0.021	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	125.5	169.6	-55.3	174.4	0	0	0	108.3	V12 L36 N38 I44 Y46 K71	V12-L65 HydrophobicContact CG2-CD1 3.8Å; L36-L65 HydrophobicContact CB-CD1 3.86Å; L36-L65 HydrophobicContact CB-CD2 4.14Å; N38-L65 HydrophobicContact CB-CB 3.77Å; N38-L65 HydrophobicContact CB-CD1 4.14Å; N38-L65 PolarHBondContact ND2-O 3.08Å; I44-L65 HydrophobicContact CB-CB 4.41Å; I44-L65 PolarHBondContact N-O 3Å; I44-L65 PolarHBondContact O-N 2.77Å; Y46-L65 HydrophobicContact CD1-CD1 4.36Å; Y46-L65 HydrophobicContact CD1-CD2 3.93Å; Y46-L65 HydrophobicContact CD1-CG 3.71Å; Y46-L65 HydrophobicContact CE1-CD2 3.7Å; Y46-L65 HydrophobicContact CE1-CG 3.98Å; L65-K71 HydrophobicContact CD2-CB 3.4Å; L65-K71 HydrophobicContact CD2-CG 4.19Å
66	Q	94.3	Very high	96.4	Very high	93 Å²	93	70.6 Å²	70.6	44%	0.435	32%	0.317	S	S	.	.			trans	-64.6	154.2	166.5	-81.4	176.6	-13.5	0	0	110.7	N38 W43 F68 R69	N38-Q66 WeakPolarHBondContact CB-O 3.35Å; N38-Q66 PolarHBondContact ND2-O 2.81Å; W43-Q66 HydrophobicContact CD2-CG 4.34Å; W43-Q66 HydrophobicContact CE3-CG 4.07Å; W43-Q66 HydrophobicContact CH2-CG 3.34Å; W43-Q66 HydrophobicContact CZ2-CG 3.59Å; W43-Q66 HydrophobicContact CZ3-CG 3.58Å; Q66-F68 PolarHBondContact O-N 2.94Å; Q66-R69 HydrophobicContact CB-CB 3.97Å; Q66-R69 HydrophobicContact CB-CG 3.52Å; Q66-R69 PolarHBondContact O-N 3.19Å
67	P	94.7	Very high	96.3	Very high	34 Å²	34	70.5 Å²	70.5	22%	0.221	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	135.2	167.2	-28.1	35.9	0	0	0	111.9	S40 T41 R69	S40-P67 WeakPolarHBondContact O-CA 3.45Å; S40-P67 WeakPolarHBondContact O-CB 3.21Å; T41-P67 WeakPolarHBondContact O-CG 3.42Å; P67-R69 PolarHBondContact O-N 3.03Å; P67-R69 VanDerWaalsContact O-N 3.11Å
68	F	95.7	Very high	96	Very high	111 Å²	111	68.1 Å²	68.1	49%	0.487	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	30	177.9	-47.4	-65.9	0	0	0	115.2	N38 T41 Q66	N38-F68 WeakPolarHBondContact O-CA 3.3Å; N38-F68 PolarHBondContact O-N 3.13Å; T41-F68 HydrophobicContact CG2-CE2 3.96Å; T41-F68 HydrophobicContact CG2-CZ 3.76Å; Q66-F68 PolarHBondContact O-N 2.94Å
69	R	97.1	Very high	94.9	Very high	155 Å²	155	68.3 Å²	68.3	59%	0.585	31%	0.31	S	S	*	.			trans	-114.5	147.5	175.3	-65	-53.5	-165	176.4	0.6	113	N38 Q66 P67	N38-R69 PolarHBondContact N-O 3.24Å; N38-R69 VanDerWaalsContact N-O 3.08Å; Q66-R69 HydrophobicContact CB-CB 3.97Å; Q66-R69 HydrophobicContact CB-CG 3.52Å; Q66-R69 PolarHBondContact O-N 3.19Å; P67-R69 PolarHBondContact O-N 3.03Å; P67-R69 VanDerWaalsContact O-N 3.11Å
70	M	96.6	Very high	93.4	Very high	87 Å²	87	63 Å²	63	43%	0.429	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	143.3	172.5	-171.5	67.3	83.9	0	0	110.4	Y15 Q35 L36 Y37	Y15-M70 HydrophobicContact CD2-CE 4.23Å; Y15-M70 HydrophobicContact CE2-CE 4.47Å; Q35-M70 HydrophobicContact CB-CE 4.4Å; Q35-M70 HydrophobicContact CB-CG 4.02Å; Q35-M70 HydrophobicContact CB-SD 3.43Å; Q35-M70 WeakPolarHBondContact CB-SD 3.26Å; L36-M70 VanDerWaalsContact C-SD 3.59Å; L36-M70 CarbonylContact O-C 3.57Å; L36-M70 WeakPolarHBondContact O-CA 3.32Å; Y37-M70 HydrophobicContact CD2-CE 4.43Å; Y37-M70 HydrophobicContact CG-CE 4.21Å
71	K	97.7	Very high	91.7	Very high	97 Å²	97	61.9 Å²	61.9	42%	0.422	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	115.3	172.9	-171.5	68.4	175.1	-176.2	0	111.3	Q35 L36 L65 I73	Q35-K71 WeakPolarHBondContact CA-O 3.32Å; L36-K71 PolarHBondContact N-O 2.85Å; L36-K71 PolarHBondContact O-N 3.05Å; L65-K71 HydrophobicContact CD2-CB 3.4Å; L65-K71 HydrophobicContact CD2-CG 4.19Å; K71-I73 HydrophobicContact CG-CD1 3.96Å
72	K	98.1	Very high	89.8	Confident	126 Å²	126	67.4 Å²	67.4	55%	0.548	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	131.8	168.9	-169.4	173.8	-173.1	172.9	0	110.2	S33	S33-K72 WeakPolarHBondContact OG-CE 3.49Å
73	I	98.1	Very high	87.8	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.3	173.2	-48.6	-62.8	0	0	0	107.5	S33 I34 L36 Y46 L48 F58 P60 K71	S33-I73 VanDerWaalsContact CA-O 3.24Å; S33-I73 WeakPolarHBondContact CA-O 3.24Å; S33-I73 WeakPolarHBondContact CB-O 3.23Å; I34-I73 HydrophobicContact CG1-CB 3.91Å; I34-I73 HydrophobicContact CG1-CG1 4.27Å; I34-I73 PolarHBondContact N-O 2.76Å; I34-I73 PolarHBondContact O-N 3.12Å; L36-I73 HydrophobicContact CD1-CD1 4.14Å; L36-I73 HydrophobicContact CD1-CG1 3.9Å; L36-I73 HydrophobicContact CG-CG1 3.91Å; Y46-I73 HydrophobicContact CE2-CD1 3.71Å; L48-I73 HydrophobicContact CD1-CG2 4.31Å; L48-I73 HydrophobicContact CD2-CG2 3.94Å; F58-I73 HydrophobicContact CB-CG2 4.37Å; P60-I73 HydrophobicContact CG-CD1 3.79Å; P60-I73 WeakPolarHBondContact O-CG2 3.32Å; K71-I73 HydrophobicContact CG-CD1 3.96Å
74	L	97.8	Very high	85.9	Confident	84 Å²	84	74.6 Å²	74.6	44%	0.44	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	137	171.7	-61.1	178.8	0	0	0	109.8	F58 R59	F58-L74 CarbonylContact C-O 3.53Å; F58-L74 WeakPolarHBondContact CA-O 3.32Å; R59-L74 PolarHBondContact N-O 2.66Å; R59-L74 PolarHBondContact O-N 3.31Å
75	V	97.1	Very high	84.1	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	108.7	177.2	-166.8	0	0	0	0	107.7	I20 F22 A32 I34 I56 F58	I20-V75 HydrophobicContact CD1-CG1 4.37Å; I20-V75 HydrophobicContact CD1-CG2 4.25Å; F22-V75 HydrophobicContact CZ-CB 4.32Å; F22-V75 HydrophobicContact CZ-CG1 3.98Å; A32-V75 HydrophobicContact CB-CB 4.42Å; A32-V75 PolarHBondContact N-O 2.9Å; A32-V75 PolarHBondContact O-N 2.94Å; I34-V75 HydrophobicContact CG1-CG2 4.45Å; I34-V75 HydrophobicContact CG2-CG2 4.25Å; I56-V75 HydrophobicContact CG2-CG1 3.94Å; F58-V75 HydrophobicContact CD1-CB 4.47Å; F58-V75 HydrophobicContact CD1-CG1 3.96Å; F58-V75 HydrophobicContact CD1-CG2 4.08Å; F58-V75 HydrophobicContact CE1-CG1 3.84Å; F58-V75 HydrophobicContact CE1-CG2 4.34Å
76	R	95.2	Very high	82.6	Confident	115 Å²	115	88 Å²	88	43%	0.434	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	129.7	174.8	-177.7	-172.8	176.4	173.9	5	108.9	T29 Q30 L31 I56 K57 T78	T29-R76 HydrophobicContact CG2-CG 3.72Å; T29-R76 PolarHBondContact OG1-NH2 3.46Å; Q30-R76 WeakPolarHBondContact O-CA 3.42Å; L31-R76 HydrophobicContact CD2-CB 3.93Å; L31-R76 HydrophobicContact CD2-CG 4.11Å; I56-R76 WeakPolarHBondContact CA-O 3.39Å; K57-R76 HydrophobicContact CB-CB 4.36Å; K57-R76 PolarHBondContact N-O 2.96Å; K57-R76 PolarHBondContact O-N 2.74Å; R76-T78 HydrophobicContact CG-CG2 4.16Å
77	C	92.5	Very high	81.4	Confident	2 Å²	2	89.7 Å²	89.7	1%	0.014	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	142.3	165.1	-164.9	0	0	0	0	110.1	F22 Q30 E55	F22-C77 HydrophobicContact CD1-CB 3.81Å; F22-C77 HydrophobicContact CD2-CB 4.15Å; F22-C77 HydrophobicContact CE1-CB 3.56Å; F22-C77 HydrophobicContact CE2-CB 3.93Å; F22-C77 HydrophobicContact CG-CB 4.1Å; F22-C77 HydrophobicContact CZ-CB 3.64Å; Q30-C77 PolarHBondContact N-O 3.11Å; Q30-C77 PolarHBondContact O-N 3.16Å; E55-C77 CarbonylContact O-C 3.57Å; E55-C77 WeakPolarHBondContact O-CA 3.32Å
78	T	89.7	Confident	80.9	Confident	54 Å²	54	92.3 Å²	92.3	33%	0.331	43%	0.434	S	S	.	.			trans	-133.8	28.2	172.5	69.5	0	0	0	0	111.7	T29 E55 R76	T29-T78 HydrophobicContact CG2-CG2 4.35Å; E55-T78 PolarHBondContact O-N 2.9Å; E55-T78 PolarHBondContact O-OG1 2.91Å; R76-T78 HydrophobicContact CG-CG2 4.16Å
79	R	75.8	Confident	80.5	Confident	40 Å²	40	87.1 Å²	87.1	15%	0.151	41%	0.412	C	S	.	.			trans	-76.6	127.9	178.3	178.2	169.1	-179.1	142.9	-15.1	109.6	E55 D84 E89 F130	E55-R79 HydrophobicContact CB-CB 4.14Å; E55-R79 HydrophobicContact CG-CB 4.28Å; R79-D84 PolarHBondContact NH2-O 3.18Å; R79-E89 IonicContact CZ-OE1 3.97Å; R79-E89 VanDerWaalsContact NH1-CG 3.26Å; R79-E89 IonicContact NH1-OE1 2.78Å; R79-E89 PolarHBondContact NH1-OE1 2.86Å; R79-F130 HydrophobicContact CB-CE1 4.36Å; R79-F130 HydrophobicContact CB-CZ 4.13Å; R79-F130 HydrophobicContact CG-CZ 4.38Å
80	L	65.1	Low	80.3	Confident	90 Å²	90	86 Å²	86	47%	0.471	41%	0.407	S	S	.	.			trans	-75.1	134.7	162.4	-54.8	-179.2	0	0	0	108	I26 D27 D82	I26-L80 HydrophobicContact CG2-CD2 4.44Å; D27-L80 WeakPolarHBondContact OD1-CD2 3.22Å; L80-D82 PolarHBondContact O-N 3.44Å
81	P	61	Low	80.3	Confident	26 Å²	26	82 Å²	82	17%	0.169	39%	0.388	C	S	.	.	S	Bend	trans	-74.3	5	-172.5	31.6	-37.9	0	0	0	114.6	R24 I26	R24-P81 HydrophobicContact CG-CB 3.67Å; R24-P81 HydrophobicContact CG-CG 4.06Å; I26-P81 HydrophobicContact CG1-CG 3.6Å
82	D	57.1	Low	80.2	Confident	137 Å²	137	79.1 Å²	79.1	73%	0.733	38%	0.378	S	S	*	.	S	Bend	trans	-113.8	29.5	-152	-159.4	37.3	0	0	0	115	L80	L80-D82 PolarHBondContact O-N 3.44Å
83	Q	54.5	Low	80.1	Confident	188 Å²	188	73.1 Å²	73.1	88%	0.879	35%	0.353	S	S	*	.	S	Bend	trans	-139.9	-14.1	175.8	-74.9	-162.2	-14.6	0	0	116.5
84	D	55.9	Low	79.9	Confident	78 Å²	78	73.3 Å²	73.3	42%	0.417	35%	0.353	S	S	.	.			trans	-159.9	102.2	-178.4	-111	-27.9	0	0	0	108.8	R79 R87	R79-D84 PolarHBondContact NH2-O 3.18Å; D84-R87 HydrophobicContact CB-CB 3.74Å; D84-R87 VanDerWaalsContact OD2-CD 3.23Å; D84-R87 WeakPolarHBondContact OD2-CD 3.45Å
85	M	57.8	Low	79.7	Confident	153 Å²	153	69.3 Å²	69.3	75%	0.754	33%	0.332	S	S	*	.	S	Bend	trans	-83.7	-17.8	172	-90.4	-169.5	53.7	0	0	113.3
86	E	63.5	Low	79.4	Confident	178 Å²	178	70 Å²	70	83%	0.832	34%	0.336	S	S	*	.	S	Bend	trans	-91.8	-17	-177.1	-59	-172.7	170.2	0	0	113.4	T88	E86-T88 PolarHBondContact O-N 3.26Å
87	R	69.7	Low	79.2	Confident	129 Å²	129	64.6 Å²	64.6	49%	0.487	32%	0.316	S	S	.	.			trans	-81	91.6	-171.1	-172.8	175.8	160.4	148.5	-1.1	112.2	D84 E89	D84-R87 HydrophobicContact CB-CB 3.74Å; D84-R87 VanDerWaalsContact OD2-CD 3.23Å; D84-R87 WeakPolarHBondContact OD2-CD 3.45Å; R87-E89 WeakPolarHBondContact CD-OE1 3.32Å; R87-E89 WeakPolarHBondContact CG-OE1 3.15Å; R87-E89 IonicContact CZ-OE1 3.66Å; R87-E89 IonicContact NE-OE1 2.74Å; R87-E89 PolarHBondContact NE-OE1 2.85Å; R87-E89 IonicContact NH2-OE1 3.77Å; R87-E89 PolarHBondContact O-N 3.05Å
88	T	82.3	Confident	79.1	Confident	88 Å²	88	65.6 Å²	65.6	54%	0.54	32%	0.321	S	S	.	.			trans	-59.5	104.8	174.5	-44.7	0	0	0	0	111.6	E86 R90 E127	E86-T88 PolarHBondContact O-N 3.26Å; T88-R90 HydrophobicContact CG2-CG 4.38Å; T88-E127 HydrophobicContact CG2-CG 4.06Å
89	E	87.8	Confident	78.9	Confident	2 Å²	2	65 Å²	65	1%	0.009	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	140.9	174.9	-67.4	-54.4	154.9	0	0	111.9	T51 S52 I56 R79 R87 V128	T51-E89 VanDerWaalsContact CB-OE2 3.26Å; T51-E89 WeakPolarHBondContact CB-OE2 3.39Å; T51-E89 PolarHBondContact OG1-OE2 2.89Å; S52-E89 VanDerWaalsContact CB-OE2 3.29Å; S52-E89 WeakPolarHBondContact CB-OE2 3.48Å; S52-E89 PolarHBondContact N-OE2 2.9Å; S52-E89 PolarHBondContact OG-OE1 2.8Å; I56-E89 HydrophobicContact CD1-CB 4.42Å; R79-E89 IonicContact CZ-OE1 3.97Å; R79-E89 VanDerWaalsContact NH1-CG 3.26Å; R79-E89 IonicContact NH1-OE1 2.78Å; R79-E89 PolarHBondContact NH1-OE1 2.86Å; R87-E89 WeakPolarHBondContact CD-OE1 3.32Å; R87-E89 WeakPolarHBondContact CG-OE1 3.15Å; R87-E89 IonicContact CZ-OE1 3.66Å; R87-E89 IonicContact NE-OE1 2.74Å; R87-E89 PolarHBondContact NE-OE1 2.85Å; R87-E89 IonicContact NH2-OE1 3.77Å; R87-E89 PolarHBondContact O-N 3.05Å; E89-V128 HydrophobicContact CB-CB 3.98Å; E89-V128 HydrophobicContact CB-CG2 4.47Å; E89-V128 PolarHBondContact O-N 2.83Å
90	R	93.4	Very high	79.2	Confident	132 Å²	132	72 Å²	72	50%	0.498	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	123.7	-172.5	-57.8	-177.1	72.6	177.9	5.9	111	T50 T51 T88 L126	T50-R90 WeakPolarHBondContact CA-O 3.25Å; T51-R90 HydrophobicContact CG2-CB 4.13Å; T51-R90 PolarHBondContact N-O 3.01Å; T51-R90 PolarHBondContact OG1-N 2.87Å; T51-R90 PolarHBondContact OG1-O 3.03Å; T88-R90 HydrophobicContact CG2-CG 4.38Å; R90-L126 CarbonylContact C-O 3.5Å; R90-L126 WeakPolarHBondContact CA-O 3.42Å
91	C	95.7	Very high	80	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.014	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	161.4	163.2	-63.1	0	0	0	0	109.9	I20 R49 F58 L126 V128	I20-C91 HydrophobicContact CD1-CB 4.28Å; R49-C91 CarbonylContact O-C 3.55Å; R49-C91 WeakPolarHBondContact O-CA 3.49Å; F58-C91 HydrophobicContact CE1-CB 4.29Å; F58-C91 HydrophobicContact CZ-CB 3.99Å; F58-C91 VanDerWaalsContact CZ-SG 3.58Å; C91-L126 HydrophobicContact CB-CB 4.16Å; C91-L126 PolarHBondContact N-O 3.49Å; C91-L126 PolarHBondContact O-N 3.27Å; C91-V128 HydrophobicContact CB-CG2 4.46Å; C91-V128 VanDerWaalsContact SG-CG2 3.52Å
92	T	96.2	Very high	80.9	Confident	37 Å²	37	72.9 Å²	72.9	23%	0.227	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	125	170.8	-59.8	0	0	0	0	110.3	L48 R49 V94 K123 C124	L48-T92 WeakPolarHBondContact CA-O 3.48Å; R49-T92 PolarHBondContact N-O 2.72Å; R49-T92 PolarHBondContact O-N 3.12Å; T92-V94 HydrophobicContact CG2-CG2 4.15Å; T92-K123 HydrophobicContact CG2-CB 4.24Å; T92-C124 CarbonylContact C-O 3.56Å; T92-C124 WeakPolarHBondContact CA-O 3.31Å
93	V	96	Very high	81.8	Confident	1 Å²	1	75.8 Å²	75.8	1%	0.006	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	116.9	166.4	-174.6	0	0	0	0	107.6	V14 I34 L36 L48 K123 C124	V14-V93 HydrophobicContact CG1-CG2 4.29Å; V14-V93 HydrophobicContact CG2-CB 4.37Å; V14-V93 HydrophobicContact CG2-CG2 4.11Å; I34-V93 HydrophobicContact CD1-CG2 4Å; L36-V93 HydrophobicContact CD1-CG1 4.21Å; L36-V93 HydrophobicContact CD2-CG1 4Å; L36-V93 HydrophobicContact CD2-CG2 3.79Å; L48-V93 HydrophobicContact CD2-CG2 4.46Å; V93-K123 WeakPolarHBondContact O-CA 3.29Å; V93-C124 HydrophobicContact CB-CB 4.23Å; V93-C124 PolarHBondContact N-O 2.9Å; V93-C124 PolarHBondContact O-N 3.34Å
94	V	94	Very high	82.4	Confident	3 Å²	3	68.1 Å²	68.1	2%	0.018	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	130.6	169.7	-178.9	0	0	0	0	107.9	Y46 K47 R49 T92 W111 I120	Y46-V94 CarbonylContact C-O 3.59Å; Y46-V94 VanDerWaalsContact CA-O 3.31Å; Y46-V94 WeakPolarHBondContact CA-O 3.41Å; K47-V94 PolarHBondContact N-O 3.49Å; K47-V94 WeakPolarHBondContact O-CB 3.35Å; K47-V94 PolarHBondContact O-N 3.04Å; R49-V94 HydrophobicContact CG-CG2 4.26Å; T92-V94 HydrophobicContact CG2-CG2 4.15Å; V94-W111 HydrophobicContact CG1-CH2 3.97Å; V94-W111 HydrophobicContact CG1-CZ3 4.34Å; V94-I120 HydrophobicContact CG1-CB 4.47Å; V94-I120 HydrophobicContact CG1-CD1 3.93Å; V94-I120 HydrophobicContact CG1-CG1 4.02Å; V94-I120 HydrophobicContact CG1-CG2 3.66Å
95	A	93.1	Very high	83.6	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	147.9	179.4	0	0	0	0	0	112.1	V12 I44 A45 D121 K122	V12-A95 HydrophobicContact CB-CB 4.23Å; V12-A95 HydrophobicContact CG1-CB 3.48Å; V12-A95 VanDerWaalsContact CG1-CB 3.48Å; I44-A95 HydrophobicContact CG2-CB 3.79Å; A45-A95 VanDerWaalsContact O-CA 3.32Å; A45-A95 WeakPolarHBondContact O-CA 3.34Å; A95-D121 PolarHBondContact O-N 3.49Å; A95-K122 PolarHBondContact N-O 3.45Å; A95-K122 PolarHBondContact O-N 2.63Å
96	H	91.6	Very high	85.2	Confident	14 Å²	14	67.4 Å²	67.4	7%	0.065	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	143.2	175.1	176.6	-103.5	0	0	0	110	A45 Y110 W111 M114 D121	A45-H96 PolarHBondContact N-O 2.94Å; A45-H96 PolarHBondContact O-N 3.02Å; H96-Y110 PolarHBondContact ND1-OH 2.89Å; H96-W111 HydrophobicContact CB-CH2 4.15Å; H96-M114 HydrophobicContact CB-CE 3.75Å; H96-M114 HydrophobicContact CB-SD 4.31Å; H96-M114 VanDerWaalsContact CD2-CE 3.46Å; H96-M114 WeakPolarHBondContact CD2-CE 3.06Å; H96-M114 VanDerWaalsContact ND1-CE 3.28Å; H96-M114 WeakPolarHBondContact ND1-CE 3.42Å; H96-D121 VanDerWaalsContact CA-OD2 3.24Å; H96-D121 WeakPolarHBondContact CA-OD2 3.39Å; H96-D121 IonicContact CD2-OD1 3.55Å; H96-D121 IonicContact CD2-OD2 3.96Å; H96-D121 PolarHBondContact CD2-OD2 2.51Å; H96-D121 IonicContact CG-OD2 2.66Å; H96-D121 IonicContact NE2-OD2 3.55Å
97	V	90.9	Very high	86.6	Confident	3 Å²	3	59.3 Å²	59.3	2%	0.018	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	126.9	175.6	172.3	0	0	0	0	109.7	R8 A10 E42 P99 D121	R8-V97 HydrophobicContact CB-CG2 4.3Å; A10-V97 HydrophobicContact CB-CG2 3.85Å; E42-V97 HydrophobicContact CB-CG1 3.91Å; E42-V97 VanDerWaalsContact CD-CG1 3.46Å; E42-V97 HydrophobicContact CG-CG1 4.29Å; E42-V97 WeakPolarHBondContact OE1-CG1 3.39Å; V97-P99 VanDerWaalsContact O-CD 3.24Å; V97-P99 WeakPolarHBondContact O-CD 3.39Å; V97-D121 PolarHBondContact N-OD2 3.08Å
98	L	89.3	Confident	87.6	Confident	23 Å²	23	58.8 Å²	58.8	12%	0.12	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-67.5	118.1	176.2	-173.4	60.9	0	0	0	109.1	W43 F64 V102 A104 Y110	W43-L98 HydrophobicContact CB-CB 3.97Å; W43-L98 HydrophobicContact CB-CD2 4.05Å; W43-L98 WeakPolarHBondContact O-CB 3.41Å; W43-L98 PolarHBondContact O-N 3.29Å; F64-L98 HydrophobicContact CE1-CD1 4.4Å; L98-V102 HydrophobicContact CD1-CB 3.99Å; L98-V102 HydrophobicContact CD1-CG1 3.79Å; L98-V102 HydrophobicContact CG-CB 4.32Å; L98-A104 HydrophobicContact CD1-CB 3.97Å; L98-A104 HydrophobicContact CD2-CB 4.3Å; L98-Y110 HydrophobicContact CD1-CD2 3.93Å; L98-Y110 HydrophobicContact CD1-CE2 3.37Å
99	P	85.8	Confident	88	Confident	41 Å²	41	58.6 Å²	58.6	27%	0.266	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-62.4	149.6	-177.3	-22.9	34.3	0	0	0	112	V97 V102	V97-P99 VanDerWaalsContact O-CD 3.24Å; V97-P99 WeakPolarHBondContact O-CD 3.39Å; P99-V102 HydrophobicContact CB-CG2 3.9Å; P99-V102 HydrophobicContact CG-CG2 4.34Å; P99-V102 VanDerWaalsContact O-CB 3.3Å; P99-V102 WeakPolarHBondContact O-CB 3.24Å; P99-V102 WeakPolarHBondContact O-CG2 3.35Å; P99-V102 PolarHBondContact O-N 3.06Å; P99-V102 VanDerWaalsContact O-N 3.13Å
100	E	82.9	Confident	88.1	Confident	186 Å²	186	59.6 Å²	59.6	87%	0.869	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	142.7	-178.9	-169.5	169.8	-169.5	0	0	111.7	V102	E100-V102 PolarHBondContact O-N 3.26Å
101	G	81.8	Confident	88	Confident	73 Å²	73	54 Å²	54	75%	0.753	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	-15.4	-174.2	0	0	0	0	0	115.6	K103	G101-K103 PolarHBondContact O-N 2.92Å
102	V	80.5	Confident	87.6	Confident	63 Å²	63	59.6 Å²	59.6	38%	0.382	32%	0.32	S	S	.	.			trans	-75.3	93.3	-178.7	-175	0	0	0	0	111.2	L98 P99 E100 A104 Y110	L98-V102 HydrophobicContact CD1-CB 3.99Å; L98-V102 HydrophobicContact CD1-CG1 3.79Å; L98-V102 HydrophobicContact CG-CB 4.32Å; P99-V102 HydrophobicContact CB-CG2 3.9Å; P99-V102 HydrophobicContact CG-CG2 4.34Å; P99-V102 VanDerWaalsContact O-CB 3.3Å; P99-V102 WeakPolarHBondContact O-CB 3.24Å; P99-V102 WeakPolarHBondContact O-CG2 3.35Å; P99-V102 PolarHBondContact O-N 3.06Å; P99-V102 VanDerWaalsContact O-N 3.13Å; E100-V102 PolarHBondContact O-N 3.26Å; V102-A104 VanDerWaalsContact C-N 3.26Å; V102-A104 HydrophobicContact CG1-CB 4.25Å; V102-A104 PolarHBondContact O-N 3.05Å; V102-Y110 HydrophobicContact CG1-CD2 4.4Å; V102-Y110 HydrophobicContact CG1-CE2 4.32Å
103	K	75.2	Confident	87.1	Confident	197 Å²	197	61.5 Å²	61.5	86%	0.857	33%	0.334	S	S	*	.			trans	-73.4	75.3	170.2	-67	-176.6	-179.9	178.6	0	111	G101 V105	G101-K103 PolarHBondContact O-N 2.92Å; K103-V105 PolarHBondContact O-N 2.89Å; K103-V105 VanDerWaalsContact O-N 3.08Å
104	A	67.9	Low	86.5	Confident	27 Å²	27	62.2 Å²	62.2	22%	0.223	34%	0.338	C	S	.	.			trans	-74.7	98.9	-177.2	0	0	0	0	0	112.3	F64 L98 V102 Y110	F64-A104 HydrophobicContact CE1-CB 3.83Å; F64-A104 HydrophobicContact CE2-CB 3.82Å; F64-A104 VanDerWaalsContact CE2-O 3.32Å; F64-A104 WeakPolarHBondContact CE2-O 3.06Å; F64-A104 HydrophobicContact CZ-CB 3.29Å; L98-A104 HydrophobicContact CD1-CB 3.97Å; L98-A104 HydrophobicContact CD2-CB 4.3Å; V102-A104 VanDerWaalsContact C-N 3.26Å; V102-A104 HydrophobicContact CG1-CB 4.25Å; V102-A104 PolarHBondContact O-N 3.05Å; A104-Y110 HydrophobicContact CB-CD2 4.23Å
105	V	79.7	Confident	85.3	Confident	149 Å²	149	68 Å²	68	90%	0.903	37%	0.366	S	S	*	.	S	Bend	trans	-70.1	-39.3	179.1	-176.9	0	0	0	0	112.1	K103	K103-V105 PolarHBondContact O-N 2.89Å; K103-V105 VanDerWaalsContact O-N 3.08Å
106	N	90.9	Very high	83.7	Confident	67 Å²	67	77 Å²	77	36%	0.358	41%	0.406	S	S	.	.			trans	-127.5	125.8	-179.4	-174.7	5.6	0	0	0	111.2	Y108 D109 Y110	N106-Y108 VanDerWaalsContact C-N 3.33Å; N106-Y108 PolarHBondContact O-N 2.98Å; N106-Y108 PolarHBondContact OD1-N 3.13Å; N106-D109 HydrophobicContact CB-CB 4.36Å; N106-D109 WeakPolarHBondContact CB-OD2 3.43Å; N106-D109 PolarHBondContact ND2-OD2 2.9Å; N106-Y110 WeakPolarHBondContact O-CB 3.45Å; N106-Y110 PolarHBondContact O-N 2.92Å; N106-Y110 VanDerWaalsContact O-N 3.12Å
107	A	93	Very high	82.7	Confident	8 Å²	8	79.3 Å²	79.3	7%	0.066	42%	0.421	C	S	.	.	H	α-helix	trans	-70	-26.2	176.5	0	0	0	0	0	113.3	Y62 G63 F64 W111	Y62-A107 HydrophobicContact CD2-CB 3.84Å; G63-A107 VanDerWaalsContact CA-CB 3.45Å; F64-A107 HydrophobicContact CD2-CB 4.19Å; F64-A107 HydrophobicContact CE1-CB 4.26Å; F64-A107 HydrophobicContact CE2-CB 3.64Å; F64-A107 VanDerWaalsContact CZ-CA 3.45Å; F64-A107 HydrophobicContact CZ-CB 3.66Å; A107-W111 WeakPolarHBondContact O-CB 3.42Å; A107-W111 PolarHBondContact O-N 2.85Å
108	Y	91.3	Very high	81.6	Confident	119 Å²	119	87.3 Å²	87.3	47%	0.467	46%	0.463	S	S	.	.	H	α-helix	trans	-64.7	-50.1	173.9	-179.5	-100.3	0	0	0	111.3	Y62 N106 W111 K112	Y62-Y108 AromaticContact CE1-CD2 3.99Å; Y62-Y108 HydrophobicContact CE1-CD2 3.99Å; Y62-Y108 AromaticContact CZ-CD2 3.97Å; N106-Y108 VanDerWaalsContact C-N 3.33Å; N106-Y108 PolarHBondContact O-N 2.98Å; N106-Y108 PolarHBondContact OD1-N 3.13Å; Y108-W111 CarbonylContact O-C 3.51Å; Y108-W111 PolarHBondContact O-N 3.43Å; Y108-K112 HydrophobicContact CE1-CD 4.35Å; Y108-K112 WeakPolarHBondContact O-CB 3.33Å; Y108-K112 PolarHBondContact O-N 2.71Å
109	D	90.3	Very high	80.9	Confident	83 Å²	83	89.4 Å²	89.4	44%	0.444	47%	0.474	S	S	.	.	H	α-helix	trans	-68.8	-37	-178	-60.9	-46.5	0	0	0	111.8	N106 K112 S113	N106-D109 HydrophobicContact CB-CB 4.36Å; N106-D109 WeakPolarHBondContact CB-OD2 3.43Å; N106-D109 PolarHBondContact ND2-OD2 2.9Å; D109-K112 WeakPolarHBondContact O-CB 3.49Å; D109-K112 PolarHBondContact O-N 2.85Å; D109-K112 VanDerWaalsContact O-N 3.13Å; D109-S113 PolarHBondContact O-N 3.35Å; D109-S113 PolarHBondContact O-OG 2.89Å
110	Y	91.2	Very high	80.5	Confident	23 Å²	23	90.2 Å²	90.2	9%	0.09	48%	0.476	C	S	.	.	H	α-helix	trans	-56.4	-52.5	169.3	178.9	-94	0	0	0	111.7	A45 F64 H96 L98 V102 A104 N106 K112 S113 M114	A45-Y110 HydrophobicContact CB-CD1 3.82Å; A45-Y110 HydrophobicContact CB-CE1 3.31Å; F64-Y110 HydrophobicContact CE1-CD1 4.08Å; F64-Y110 HydrophobicContact CE1-CG 4.09Å; F64-Y110 HydrophobicContact CZ-CG 4.24Å; H96-Y110 PolarHBondContact ND1-OH 2.89Å; L98-Y110 HydrophobicContact CD1-CD2 3.93Å; L98-Y110 HydrophobicContact CD1-CE2 3.37Å; V102-Y110 HydrophobicContact CG1-CD2 4.4Å; V102-Y110 HydrophobicContact CG1-CE2 4.32Å; A104-Y110 HydrophobicContact CB-CD2 4.23Å; N106-Y110 WeakPolarHBondContact O-CB 3.45Å; N106-Y110 PolarHBondContact O-N 2.92Å; N106-Y110 VanDerWaalsContact O-N 3.12Å; Y110-K112 PolarHBondContact O-N 3.15Å; Y110-K112 VanDerWaalsContact O-N 3.16Å; Y110-S113 PolarHBondContact O-N 2.96Å; Y110-S113 PolarHBondContact O-OG 2.85Å; Y110-M114 HydrophobicContact CE1-SD 3.68Å; Y110-M114 WeakPolarHBondContact O-CB 3.31Å; Y110-M114 PolarHBondContact O-N 2.87Å
111	W	90.5	Very high	80.5	Confident	14 Å²	14	84.4 Å²	84.4	5%	0.053	45%	0.451	C	S	.	.	H	α-helix	trans	-71	-6.3	177.5	-79.4	115.7	0	0	0	114.5	A45 Y46 K47 V94 H96 A107 Y108 M114 M115	A45-W111 HydrophobicContact CB-CZ2 4.03Å; Y46-W111 VanDerWaalsContact C-NE1 3.25Å; Y46-W111 PolarHBondContact O-NE1 2.98Å; K47-W111 HydrophobicContact CB-CD2 3.77Å; K47-W111 VanDerWaalsContact CB-CE2 3.49Å; K47-W111 HydrophobicContact CB-CE3 4.34Å; K47-W111 HydrophobicContact CB-CG 4.11Å; K47-W111 HydrophobicContact CB-CH2 4.4Å; K47-W111 HydrophobicContact CB-CZ2 3.83Å; K47-W111 HydrophobicContact CD-CB 4.12Å; K47-W111 HydrophobicContact CD-CD2 3.89Å; K47-W111 HydrophobicContact CD-CE3 4.07Å; K47-W111 HydrophobicContact CD-CG 3.92Å; K47-W111 HydrophobicContact CG-CD2 4.5Å; V94-W111 HydrophobicContact CG1-CH2 3.97Å; V94-W111 HydrophobicContact CG1-CZ3 4.34Å; H96-W111 HydrophobicContact CB-CH2 4.15Å; A107-W111 WeakPolarHBondContact O-CB 3.42Å; A107-W111 PolarHBondContact O-N 2.85Å; Y108-W111 CarbonylContact O-C 3.51Å; Y108-W111 PolarHBondContact O-N 3.43Å; W111-M114 HydrophobicContact CE3-SD 3.92Å; W111-M114 HydrophobicContact CH2-SD 4.21Å; W111-M114 HydrophobicContact CZ3-CE 4.41Å; W111-M114 HydrophobicContact CZ3-SD 3.62Å; W111-M115 WeakPolarHBondContact O-CG 3.4Å
112	K	88.5	Confident	80.9	Confident	121 Å²	121	84.4 Å²	84.4	53%	0.526	43%	0.43	S	S	.	.	H	α-helix	trans	-91.3	-49.2	173	-173.9	-176.9	176.5	-171.8	0	111	Y108 D109 Y110 M114 M115	Y108-K112 HydrophobicContact CE1-CD 4.35Å; Y108-K112 WeakPolarHBondContact O-CB 3.33Å; Y108-K112 PolarHBondContact O-N 2.71Å; D109-K112 WeakPolarHBondContact O-CB 3.49Å; D109-K112 PolarHBondContact O-N 2.85Å; D109-K112 VanDerWaalsContact O-N 3.13Å; Y110-K112 PolarHBondContact O-N 3.15Å; Y110-K112 VanDerWaalsContact O-N 3.16Å; K112-M114 VanDerWaalsContact C-N 3.28Å; K112-M114 PolarHBondContact O-N 2.87Å; K112-M115 PolarHBondContact O-N 2.91Å
113	S	85.7	Confident	81.4	Confident	77 Å²	77	88 Å²	88	54%	0.538	44%	0.44	S	S	.	.	H	α-helix	trans	-66.3	-32.1	175.4	61.4	0	0	0	0	112.2	D109 Y110 M115 F116	D109-S113 PolarHBondContact O-N 3.35Å; D109-S113 PolarHBondContact O-OG 2.89Å; Y110-S113 PolarHBondContact O-N 2.96Å; Y110-S113 PolarHBondContact O-OG 2.85Å; S113-M115 VanDerWaalsContact C-N 3.25Å; S113-M115 PolarHBondContact O-N 2.59Å; S113-F116 WeakPolarHBondContact O-CD2 3.34Å
114	M	82.8	Confident	82.3	Confident	15 Å²	15	79.4 Å²	79.4	7%	0.074	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-70.3	-13.9	177.2	-165.7	-178.8	176.8	0	0	114	H96 Y110 W111 K112 F116 T117 L119	H96-M114 HydrophobicContact CB-CE 3.75Å; H96-M114 HydrophobicContact CB-SD 4.31Å; H96-M114 VanDerWaalsContact CD2-CE 3.46Å; H96-M114 WeakPolarHBondContact CD2-CE 3.06Å; H96-M114 VanDerWaalsContact ND1-CE 3.28Å; H96-M114 WeakPolarHBondContact ND1-CE 3.42Å; Y110-M114 HydrophobicContact CE1-SD 3.68Å; Y110-M114 WeakPolarHBondContact O-CB 3.31Å; Y110-M114 PolarHBondContact O-N 2.87Å; W111-M114 HydrophobicContact CE3-SD 3.92Å; W111-M114 HydrophobicContact CH2-SD 4.21Å; W111-M114 HydrophobicContact CZ3-CE 4.41Å; W111-M114 HydrophobicContact CZ3-SD 3.62Å; K112-M114 VanDerWaalsContact C-N 3.28Å; K112-M114 PolarHBondContact O-N 2.87Å; M114-F116 PolarHBondContact O-N 2.92Å; M114-T117 PolarHBondContact O-N 3.05Å; M114-T117 PolarHBondContact O-OG1 2.74Å; M114-L119 HydrophobicContact CE-CB 3.91Å; M114-L119 WeakPolarHBondContact CE-O 3.03Å
115	M	68.1	Low	83.6	Confident	125 Å²	125	80.8 Å²	80.8	62%	0.616	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-66.8	-11	-177.8	-58.9	-143.2	-116.4	0	0	114.3	W111 K112 S113	W111-M115 WeakPolarHBondContact O-CG 3.4Å; K112-M115 PolarHBondContact O-N 2.91Å; S113-M115 VanDerWaalsContact C-N 3.25Å; S113-M115 PolarHBondContact O-N 2.59Å
116	F	60.5	Low	84.3	Confident	189 Å²	189	73.9 Å²	73.9	83%	0.829	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-85.4	-6.7	172.2	-55.2	-69.7	0	0	0	113.7	S113 M114	S113-F116 WeakPolarHBondContact O-CD2 3.34Å; M114-F116 PolarHBondContact O-N 2.92Å
117	T	70.4	Confident	84.5	Confident	63 Å²	63	74.1 Å²	74.1	39%	0.387	37%	0.369	S	S	.	.	S	Bend	trans	-115.5	128.4	174.9	63.2	0	0	0	0	110.6	M114 L119	M114-T117 PolarHBondContact O-N 3.05Å; M114-T117 PolarHBondContact O-OG1 2.74Å; T117-L119 PolarHBondContact O-N 2.78Å
118	N	68.1	Low	84.5	Confident	170 Å²	170	74.1 Å²	74.1	91%	0.909	37%	0.368	S	S	*	.			trans	-76.8	21.4	177.4	-74.3	-51.2	0	0	0	113.3	I120	N118-I120 PolarHBondContact O-N 3.47Å
119	L	74.1	Confident	84.4	Confident	67 Å²	67	71.7 Å²	71.7	35%	0.351	36%	0.36	S	S	.	.			trans	-77	112.5	-177.8	-63.5	172	0	0	0	109.4	M114 T117	M114-L119 HydrophobicContact CE-CB 3.91Å; M114-L119 WeakPolarHBondContact CE-O 3.03Å; T117-L119 PolarHBondContact O-N 2.78Å
120	I	77.8	Confident	84.2	Confident	58 Å²	58	69.7 Å²	69.7	30%	0.297	35%	0.347	S	S	.	.			trans	-141.3	107	172.1	-63.9	176.6	0	0	0	106.9	V94 N118 K122 K123	V94-I120 HydrophobicContact CG1-CB 4.47Å; V94-I120 HydrophobicContact CG1-CD1 3.93Å; V94-I120 HydrophobicContact CG1-CG1 4.02Å; V94-I120 HydrophobicContact CG1-CG2 3.66Å; N118-I120 PolarHBondContact O-N 3.47Å; I120-K122 WeakPolarHBondContact CG2-O 3.4Å; I120-K123 HydrophobicContact CG2-CD 4.36Å; I120-K123 HydrophobicContact CG2-CG 3.66Å
121	D	81.8	Confident	83.9	Confident	65 Å²	65	72 Å²	72	35%	0.348	36%	0.361	S	S	.	.	S	Bend	trans	-75.9	-33.7	-175.5	-51.7	-40.7	0	0	0	111.9	A10 A95 H96 V97	A10-D121 HydrophobicContact CB-CB 3.42Å; A10-D121 VanDerWaalsContact CB-CB 3.42Å; A95-D121 PolarHBondContact O-N 3.49Å; H96-D121 VanDerWaalsContact CA-OD2 3.24Å; H96-D121 WeakPolarHBondContact CA-OD2 3.39Å; H96-D121 IonicContact CD2-OD1 3.55Å; H96-D121 IonicContact CD2-OD2 3.96Å; H96-D121 PolarHBondContact CD2-OD2 2.51Å; H96-D121 IonicContact CG-OD2 2.66Å; H96-D121 IonicContact NE2-OD2 3.55Å; V97-D121 PolarHBondContact N-OD2 3.08Å
122	K	90.1	Very high	83.1	Confident	72 Å²	72	77.1 Å²	77.1	31%	0.313	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	142.8	176.6	-162.8	166.6	-179.5	-173.8	0	113.4	A10 V12 A95 I120 C124	A10-K122 VanDerWaalsContact O-CD 3.23Å; A10-K122 WeakPolarHBondContact O-CD 3.26Å; V12-K122 HydrophobicContact CG1-CB 4.36Å; V12-K122 HydrophobicContact CG1-CD 3.97Å; V12-K122 HydrophobicContact CG1-CG 4.4Å; V12-K122 PolarHBondContact O-NZ 2.9Å; A95-K122 PolarHBondContact N-O 3.45Å; A95-K122 PolarHBondContact O-N 2.63Å; I120-K122 WeakPolarHBondContact CG2-O 3.4Å; K122-C124 VanDerWaalsContact CE-SG 3.59Å
123	K	92.4	Very high	82	Confident	138 Å²	138	74 Å²	74	60%	0.6	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	118.8	167.5	-61.7	174.1	-173.3	167.1	0	107.7	T92 V93 I120 P125	T92-K123 HydrophobicContact CG2-CB 4.24Å; V93-K123 WeakPolarHBondContact O-CA 3.29Å; I120-K123 HydrophobicContact CG2-CD 4.36Å; I120-K123 HydrophobicContact CG2-CG 3.66Å; K123-P125 WeakPolarHBondContact O-CD 3.38Å
124	C	93.4	Very high	80.4	Confident	17 Å²	17	75.5 Å²	75.5	12%	0.115	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	102.3	170.9	-53.2	0	0	0	0	107.7	V14 T92 V93 K122	V14-C124 HydrophobicContact CG2-CB 3.74Å; T92-C124 CarbonylContact C-O 3.56Å; T92-C124 WeakPolarHBondContact CA-O 3.31Å; V93-C124 HydrophobicContact CB-CB 4.23Å; V93-C124 PolarHBondContact N-O 2.9Å; V93-C124 PolarHBondContact O-N 3.34Å; K122-C124 VanDerWaalsContact CE-SG 3.59Å
125	P	94.7	Very high	79	Confident	57 Å²	57	84.4 Å²	84.4	37%	0.37	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	151.6	170.9	31.6	-34.2	0	0	0	109.7	K123	K123-P125 WeakPolarHBondContact O-CD 3.38Å
126	L	95.7	Very high	78.1	Confident	3 Å²	3	85.6 Å²	85.6	2%	0.016	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	129	166.9	-61.5	171.1	0	0	0	107.6	V14 D18 I20 I34 R90 C91	V14-L126 HydrophobicContact CG1-CD1 3.94Å; V14-L126 HydrophobicContact CG1-CD2 4.08Å; V14-L126 HydrophobicContact CG1-CG 4.43Å; D18-L126 CarbonylContact O-C 3.49Å; D18-L126 WeakPolarHBondContact O-CA 3.23Å; I20-L126 HydrophobicContact CD1-CB 4.4Å; I20-L126 HydrophobicContact CD1-CD1 3.78Å; I20-L126 HydrophobicContact CG1-CB 4.31Å; I20-L126 HydrophobicContact CG1-CD1 3.93Å; I34-L126 HydrophobicContact CD1-CD1 3.92Å; I34-L126 HydrophobicContact CG2-CD1 4.08Å; R90-L126 CarbonylContact C-O 3.5Å; R90-L126 WeakPolarHBondContact CA-O 3.42Å; C91-L126 HydrophobicContact CB-CB 4.16Å; C91-L126 PolarHBondContact N-O 3.49Å; C91-L126 PolarHBondContact O-N 3.27Å
127	E	94.1	Very high	77.7	Confident	73 Å²	73	82.4 Å²	82.4	34%	0.341	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	152.7	166.9	-159.3	-178.4	165.8	0	0	109.9	D18 T19 I20 T88 K129	D18-E127 PolarHBondContact O-N 2.67Å; T19-E127 CarbonylContact C-O 3.56Å; T19-E127 WeakPolarHBondContact CA-O 2.99Å; T19-E127 HydrophobicContact CG2-CB 4.5Å; I20-E127 PolarHBondContact N-O 2.92Å; T88-E127 HydrophobicContact CG2-CG 4.06Å; E127-K129 VanDerWaalsContact CD-CE 3.41Å; E127-K129 HydrophobicContact CG-CG 4.47Å; E127-K129 WeakPolarHBondContact OE1-CE 3.3Å; E127-K129 IonicContact OE1-NZ 2.72Å; E127-K129 WeakPolarHBondContact OE2-CE 3.38Å; E127-K129 IonicContact OE2-NZ 3.8Å; E127-K129 PolarHBondContact OE2-NZ 3.47Å
128	V	92.1	Very high	77	Confident	8 Å²	8	84.8 Å²	84.8	5%	0.048	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	114.1	175.1	-177.9	0	0	0	0	108.4	I20 F22 I56 E89 C91 F130	I20-V128 WeakPolarHBondContact O-CA 3.35Å; F22-V128 HydrophobicContact CD2-CG1 3.62Å; F22-V128 HydrophobicContact CE2-CG1 3.79Å; I56-V128 HydrophobicContact CD1-CG1 4.29Å; I56-V128 HydrophobicContact CD1-CG2 4.21Å; E89-V128 HydrophobicContact CB-CB 3.98Å; E89-V128 HydrophobicContact CB-CG2 4.47Å; E89-V128 PolarHBondContact O-N 2.83Å; C91-V128 HydrophobicContact CB-CG2 4.46Å; C91-V128 VanDerWaalsContact SG-CG2 3.52Å; V128-F130 HydrophobicContact CG1-CE2 4.1Å; V128-F130 HydrophobicContact CG1-CZ 4.15Å
129	K	90	Very high	76.5	Confident	67 Å²	67	85.2 Å²	85.2	29%	0.291	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	145.6	-178.2	-67.7	-167.7	177.8	92.8	0	111.3	T19 I20 F22 E127	T19-K129 HydrophobicContact CG2-CB 4.08Å; T19-K129 HydrophobicContact CG2-CD 3.85Å; T19-K129 HydrophobicContact CG2-CG 3.69Å; T19-K129 PolarHBondContact OG1-NZ 3.35Å; I20-K129 PolarHBondContact O-N 2.85Å; F22-K129 PolarHBondContact N-O 2.82Å; E127-K129 VanDerWaalsContact CD-CE 3.41Å; E127-K129 HydrophobicContact CG-CG 4.47Å; E127-K129 WeakPolarHBondContact OE1-CE 3.3Å; E127-K129 IonicContact OE1-NZ 2.72Å; E127-K129 WeakPolarHBondContact OE2-CE 3.38Å; E127-K129 IonicContact OE2-NZ 3.8Å; E127-K129 PolarHBondContact OE2-NZ 3.47Å
130	F	87	Confident	76	Confident	42 Å²	42	87 Å²	87	18%	0.184	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	87.1	176.4	-65.8	-83.3	0	0	0	108.1	F22 R79 V128	F22-F130 HydrophobicContact CB-CD1 3.87Å; F22-F130 HydrophobicContact CB-CE1 3.94Å; F22-F130 HydrophobicContact CD2-CE1 4.47Å; F22-F130 HydrophobicContact CG-CE1 4.43Å; F22-F130 CarbonylContact O-C 3.58Å; F22-F130 VanDerWaalsContact O-CA 3.31Å; F22-F130 WeakPolarHBondContact O-CA 3.29Å; R79-F130 HydrophobicContact CB-CE1 4.36Å; R79-F130 HydrophobicContact CB-CZ 4.13Å; R79-F130 HydrophobicContact CG-CZ 4.38Å; V128-F130 HydrophobicContact CG1-CE2 4.1Å; V128-F130 HydrophobicContact CG1-CZ 4.15Å
131	D	83.7	Confident	75.1	Confident	70 Å²	70	90.6 Å²	90.6	37%	0.374	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	139.3	-179.1	-58.6	-29.3	0	0	0	108.9	H21 F22 S23 R24 D133	H21-D131 WeakPolarHBondContact CB-OD2 3.31Å; H21-D131 IonicContact CE1-OD1 3.7Å; H21-D131 IonicContact CE1-OD2 3.42Å; H21-D131 IonicContact CG-OD2 3.04Å; H21-D131 VanDerWaalsContact ND1-CG 3.27Å; H21-D131 IonicContact ND1-OD1 2.66Å; H21-D131 PolarHBondContact ND1-OD1 3.16Å; H21-D131 IonicContact ND1-OD2 3.68Å; H21-D131 PolarHBondContact ND1-OD2 2.94Å; F22-D131 PolarHBondContact O-N 3.24Å; S23-D131 CarbonylContact C-O 3.49Å; R24-D131 WeakPolarHBondContact CB-O 3.37Å; R24-D131 PolarHBondContact N-O 3.39Å; D131-D133 PolarHBondContact O-N 2.92Å; D131-D133 VanDerWaalsContact O-N 3.15Å
132	L	74.6	Confident	74.2	Confident	122 Å²	122	92.4 Å²	92.4	64%	0.639	50%	0.498	S	S	*	.			trans	-65.4	114.9	161.7	-76.9	161.5	0	0	0	106.8	S134	L132-S134 PolarHBondContact O-N 2.95Å
133	D	65.7	Low	72.4	Confident	57 Å²	57	95.9 Å²	95.9	31%	0.305	53%	0.526	S	S	.	.			trans	-50.8	134.4	167.6	-59	-89.4	0	0	0	108.4	S23 R24 I25 D131 Y135	S23-D133 WeakPolarHBondContact CB-OD1 3.23Å; S23-D133 VanDerWaalsContact CB-OD2 3.29Å; S23-D133 WeakPolarHBondContact CB-OD2 3.09Å; S23-D133 PolarHBondContact OG-OD1 3.3Å; R24-D133 PolarHBondContact N-OD2 2.86Å; I25-D133 PolarHBondContact N-OD2 2.97Å; D131-D133 PolarHBondContact O-N 2.92Å; D131-D133 VanDerWaalsContact O-N 3.15Å; D133-Y135 PolarHBondContact O-N 2.94Å
134	S	51.6	Low	70.6	Confident	108 Å²	108	94 Å²	94	76%	0.755	53%	0.53	S	S	*	.			trans	-63.3	101.7	176.2	51.6	0	0	0	0	108.1	L132 D136	L132-S134 PolarHBondContact O-N 2.95Å; S134-D136 VanDerWaalsContact C-N 3.35Å; S134-D136 PolarHBondContact O-N 3.06Å
135	Y	53.2	Low	68.7	Low	202 Å²	202	98.5 Å²	98.5	79%	0.792	56%	0.562	S	S	*	*			trans	-57.1	104.2	163.3	-75.6	-88.8	0	0	0	106.9	D133 V137	D133-Y135 PolarHBondContact O-N 2.94Å; Y135-V137 VanDerWaalsContact C-N 3.33Å; Y135-V137 PolarHBondContact O-N 2.71Å
136	D	49.7	Very low	66.6	Low	149 Å²	149	105.8 Å²	105.8	80%	0.797	58%	0.583	S	S	*	*			trans	-54.9	107	158.7	-79.7	-43.5	0	0	0	105.9	S134 P138	S134-D136 VanDerWaalsContact C-N 3.35Å; S134-D136 PolarHBondContact O-N 3.06Å; D136-P138 VanDerWaalsContact O-CD 3.31Å; D136-P138 WeakPolarHBondContact O-CD 3.22Å; D136-P138 VanDerWaalsContact O-N 3.16Å
137	V	50.5	Low	64.7	Low	122 Å²	122	111.6 Å²	111.6	74%	0.739	62%	0.619	S	S	*	*			trans	-59	121.2	-176.4	174.9	0	0	0	0	106.8	Y135 E139	Y135-V137 VanDerWaalsContact C-N 3.33Å; Y135-V137 PolarHBondContact O-N 2.71Å; V137-E139 PolarHBondContact O-N 3.2Å
138	P	56.8	Low	62.6	Low	114 Å²	114	112.2 Å²	112.2	74%	0.74	63%	0.631	S	S	*	*			trans	-57.8	113.8	174.8	-23	33.8	0	0	0	108.1	D136	D136-P138 VanDerWaalsContact O-CD 3.31Å; D136-P138 WeakPolarHBondContact O-CD 3.22Å; D136-P138 VanDerWaalsContact O-N 3.16Å
139	E	57.7	Low	60.8	Low	178 Å²	178	117.6 Å²	117.6	83%	0.832	67%	0.669	S	S	*	*			trans	-56	127.7	-176.3	-170.6	175.3	-137	0	0	108.6	V137 V141	V137-E139 PolarHBondContact O-N 3.2Å; E139-V141 PolarHBondContact O-N 3.22Å
140	P	63	Low	58.7	Low	105 Å²	105	119.6 Å²	119.6	68%	0.682	69%	0.692	S	S	*	*			trans	-66.5	102.6	-168.8	24.5	-33.9	0	0	0	110.6	S142	P140-S142 PolarHBondContact O-N 2.82Å; P140-S142 PolarHBondContact O-OG 2.85Å
141	V	59.3	Low	57.2	Low	133 Å²	133	124.9 Å²	124.9	81%	0.806	72%	0.72	S	S	*	*			trans	-53.6	110.8	179	-171.5	0	0	0	0	108.6	E139 T143	E139-V141 PolarHBondContact O-N 3.22Å; V141-T143 PolarHBondContact O-N 2.94Å
142	S	63.6	Low	55.9	Low	104 Å²	104	128.8 Å²	128.8	73%	0.727	74%	0.74	S	S	*	*			trans	-74.5	94.7	-162.1	-70	0	0	0	0	112.3	P140 S144	P140-S142 PolarHBondContact O-N 2.82Å; P140-S142 PolarHBondContact O-OG 2.85Å; S142-S144 PolarHBondContact O-N 3.32Å
143	T	51.7	Low	54.6	Low	144 Å²	144	127.6 Å²	127.6	88%	0.883	75%	0.747	S	S	*	*			trans	-78.5	61.7	177.7	42.4	0	0	0	0	112.2	V141	V141-T143 PolarHBondContact O-N 2.94Å
144	S	55.4	Low	53.7	Low	99 Å²	99	131.5 Å²	131.5	69%	0.692	77%	0.773	S	S	*	*			trans	-121.3	87.3	-173.8	63.6	0	0	0	0	114.5	S142	S142-S144 PolarHBondContact O-N 3.32Å
145	S	51.9	Low	53.6	Low	111 Å²	111	132.7 Å²	132.7	78%	0.776	78%	0.776	S	S	*	*			trans	-159	61	158.7	48.7	0	0	0	0	112.4	T147	S145-T147 PolarHBondContact O-N 2.95Å
146	Y	52.2	Low	53.6	Low	211 Å²	211	128.9 Å²	128.9	83%	0.827	78%	0.779	S	S	*	*			trans	-77.8	105.8	168.5	-173.5	-86.6	0	0	0	110.1	S148	Y146-S148 WeakPolarHBondContact CE1-OG 3.08Å; Y146-S148 PolarHBondContact OH-OG 3.26Å
147	T	55.9	Low	53.6	Low	125 Å²	125	127 Å²	127	77%	0.767	78%	0.778	S	S	*	*			trans	-128.7	98.1	168.9	46.7	0	0	0	0	110.4	S145 S149	S145-T147 PolarHBondContact O-N 2.95Å; T147-S149 PolarHBondContact O-N 3.42Å
148	S	49.2	Very low	53.7	Low	86 Å²	86	126.5 Å²	126.5	60%	0.601	78%	0.777	S	S	*	*			trans	-68.5	121.8	169.8	-53.3	0	0	0	0	111	Y146	Y146-S148 WeakPolarHBondContact CE1-OG 3.08Å; Y146-S148 PolarHBondContact OH-OG 3.26Å
149	S	53.5	Low	53.8	Low	120 Å²	120	130.1 Å²	130.1	84%	0.839	78%	0.784	S	S	*	*			trans	-139.8	108	159.8	-74.7	0	0	0	0	108.3	T147	T147-S149 PolarHBondContact O-N 3.42Å
150	S	46.8	Very low	53.6	Low	110 Å²	110	130.2 Å²	130.2	77%	0.769	78%	0.784	S	S	*	*			trans	-83.7	139.6	168	51	0	0	0	0	109.7
151	I	55.2	Low	53.3	Low	153 Å²	153	130.4 Å²	130.4	79%	0.785	79%	0.788	S	S	*	*			trans	-175.2	127.5	148.4	-102.2	152.2	0	0	0	110.3
152	I	56.7	Low	53.1	Low	152 Å²	152	132.9 Å²	132.9	78%	0.779	79%	0.791	S	S	*	*			trans	50.6	128.3	155.1	-58	172.2	0	0	0	118.9
153	A	46.7	Very low	52.8	Low	96 Å²	96	133.1 Å²	133.1	79%	0.793	79%	0.793	S	S	*	*			trans	-90.4	139.8	174.2	0	0	0	0	0	112.8
154	T	47.1	Very low	52.8	Low	139 Å²	139	132.7 Å²	132.7	85%	0.853	79%	0.79	S	S	*	*			trans	-143.7	153	153.9	-22	0	0	0	0	109.9
155	T	50.1	Low	52.4	Low	134 Å²	134	134.8 Å²	134.8	82%	0.822	80%	0.799	S	S	*	*			trans	-98.2	135.8	-170.5	50.7	0	0	0	0	113.7
156	S	53.3	Low	52.6	Low	121 Å²	121	135.4 Å²	135.4	85%	0.846	80%	0.803	S	S	*	*			trans	-176.2	145.8	135	53.1	0	0	0	0	114
157	S	48.6	Very low	52.5	Low	111 Å²	111	130.8 Å²	130.8	78%	0.776	80%	0.801	S	S	*	*			trans	-21.8	149	173.3	-150.1	0	0	0	0	120.8
158	P	53.1	Low	52.9	Low	110 Å²	110	130.6 Å²	130.6	71%	0.714	81%	0.805	S	S	*	*			trans	-85.9	166.1	165.3	38.2	-36.5	0	0	0	112.9
159	E	58	Low	53.3	Low	191 Å²	191	135.1 Å²	135.1	89%	0.893	82%	0.817	S	S	*	*			trans	-166.6	177.8	132.3	-110	166	-170.6	0	0	111.3
160	E	53.4	Low	53.9	Low	180 Å²	180	135.3 Å²	135.3	84%	0.841	82%	0.819	S	S	*	*			trans	-82.5	157.1	-158.3	-58.9	166.8	83.3	0	0	116.2
161	S	57.8	Low	54.3	Low	108 Å²	108	135.6 Å²	135.6	76%	0.755	82%	0.815	S	S	*	*				177.4	120.1	127	-78	0	0	0	0	115.1
162	E	55.2	Low	54.6	Low	186 Å²	186	136.4 Å²	136.4	87%	0.869	82%	0.819	S	S	*	*			trans	54.5	175.7	136.5	-58.7	-159.4	110.3	0	0	123.7
163	S	57.3	Low	54	Low	109 Å²	109	134.1 Å²	134.1	76%	0.762	81%	0.813	S	S	*	*			trans	77.7	143	172	85	0	0	0	0	117.1
164	T	51.8	Low	54.8	Low	135 Å²	135	135.2 Å²	135.2	83%	0.828	82%	0.815	S	S	*	*			cis	-152.5	154.8	-18	-0.1	0	0	0	0	110
165	T	46.7	Very low	54.7	Low	143 Å²	143	134.6 Å²	134.6	88%	0.877	81%	0.811	S	S	*	*			trans	-77	148.1	167.6	38.9	0	0	0	0	112
166	S	56.6	Low	55	Low	124 Å²	124	133.4 Å²	133.4	87%	0.867	81%	0.808	S	S	*	*			trans	-151.3	156.8	164.4	-166	0	0	0	0	110.8
167	S	50.1	Low	55	Low	113 Å²	113	133 Å²	133	79%	0.79	81%	0.805	S	S	*	*			trans	-100.9	156.8	-161.9	-55.1	0	0	0	0	114.3
168	S	63.4	Low	55.6	Low	122 Å²	122	133.8 Å²	133.8	85%	0.853	81%	0.81	S	S	*	*			trans	-146.5	123.5	149.8	55.7	0	0	0	0	110.2
169	E	58.6	Low	55.5	Low	180 Å²	180	133.1 Å²	133.1	84%	0.841	81%	0.809	S	S	*	*			trans	-84.3	155.1	-178.6	-62.6	165.3	86.7	0	0	112.2
170	S	64.4	Low	55.3	Low	125 Å²	125	134.6 Å²	134.6	87%	0.874	81%	0.806	S	S	*	*			trans	-149.7	141.4	146	61.6	0	0	0	0	110.5
171	V	55.4	Low	55.7	Low	115 Å²	115	134 Å²	134	70%	0.697	80%	0.803	S	S	*	*			trans	-130.6	120.4	-172.6	174.7	0	0	0	0	109.2
172	I	62.4	Low	55.2	Low	170 Å²	170	134.5 Å²	134.5	87%	0.872	81%	0.807	S	S	*	*			trans	-139.7	122.5	156.2	-50.2	179.9	0	0	0	109
173	T	43.9	Very low	55.4	Low	105 Å²	105	129.3 Å²	129.3	64%	0.644	80%	0.803	S	S	*	*			trans	-96.4	146.2	176.5	-50.3	0	0	0	0	110.4
174	S	64.1	Low	55.1	Low	119 Å²	119	130.9 Å²	130.9	83%	0.832	81%	0.808	S	S	*	*			trans	-154.3	138	158.8	-83.2	0	0	0	0	111.3
175	T	45	Very low	54.8	Low	125 Å²	125	129.2 Å²	129.2	77%	0.767	80%	0.802	S	S	*	*			trans	-142.7	117.4	-163.7	-51.9	0	0	0	0	111.8
176	S	56.4	Low	55	Low	110 Å²	110	129.2 Å²	129.2	77%	0.769	80%	0.802	S	S	*	*			trans	-166.8	125.7	157.1	50	0	0	0	0	109.3
177	S	53.7	Low	54.4	Low	113 Å²	113	129.1 Å²	129.1	79%	0.79	80%	0.797	S	S	*	*			cis	84.8	96.4	36	83.3	0	0	0	0	114.9
178	S	60.4	Low	54.6	Low	126 Å²	126	130.1 Å²	130.1	88%	0.881	80%	0.798	S	S	*	*			trans	-157.6	166.7	147.8	-163.9	0	0	0	0	109.8
179	S	50.8	Low	53.9	Low	97 Å²	97	129 Å²	129	68%	0.678	79%	0.79	S	S	*	*			trans	-155.9	172.7	-166.9	65.3	0	0	0	0	113.6
180	R	53.6	Low	53.3	Low	221 Å²	221	125.9 Å²	125.9	83%	0.834	79%	0.788	S	S	*	*			trans	74.4	160.2	177.7	-58.3	-179.9	168.6	179	-4.5	114.5
181	E	62.2	Low	53.2	Low	167 Å²	167	128 Å²	128	78%	0.78	79%	0.788	S	S	*	*			cis	-140.9	170.1	9.2	-152.5	150.1	107	0	0	113.6
182	S	48	Very low	52.7	Low	120 Å²	120	129.4 Å²	129.4	84%	0.839	79%	0.791	S	S	*	*			trans	-100	150.4	-178.7	-50.7	0	0	0	0	112.3
183	G	59.6	Low	52.5	Low	76 Å²	76	127 Å²	127	78%	0.784	79%	0.79	S	S	*	*			trans	-152.8	151.3	176.4	0	0	0	0	0	112.4
184	T	49.5	Very low	52.6	Low	142 Å²	142	127.9 Å²	127.9	87%	0.871	80%	0.795	S	S	*	*			trans	-118	158.6	-153.7	-50.2	0	0	0	0	114.8
185	S	45.5	Very low	52.4	Low	100 Å²	100	128.7 Å²	128.7	70%	0.699	80%	0.795	S	S	*	*			trans	-45.2	157.3	-177.6	-39	0	0	0	0	118.7
186	T	51.4	Low	52.5	Low	144 Å²	144	128.3 Å²	128.3	88%	0.883	79%	0.793	S	S	*	*			trans	-149.7	147.2	142.9	-71	0	0	0	0	109.7
187	T	44	Very low	52.1	Low	122 Å²	122	129.6 Å²	129.6	75%	0.748	80%	0.796	S	S	*	*			trans	-116.7	150.1	-168.7	-58.5	0	0	0	0	111.5
188	T	54.7	Low	51.9	Low	134 Å²	134	129.6 Å²	129.6	82%	0.822	80%	0.796	S	S	*	*			trans	-160.7	153.3	144.8	2.3	0	0	0	0	114
189	S	48.2	Very low	51.3	Low	97 Å²	97	128.7 Å²	128.7	68%	0.678	79%	0.789	S	S	*	*			trans	-49.3	143.6	175.5	43.4	0	0	0	0	114.8
190	S	45.8	Very low	51.5	Low	115 Å²	115	129.6 Å²	129.6	80%	0.804	80%	0.796	S	S	*	*				71.2	123.1	56.3	-51.3	0	0	0	0	114.7
191	I	62.7	Low	51.4	Low	169 Å²	169	125.5 Å²	125.5	87%	0.867	80%	0.795	S	S	*	*			trans	-161.6	134.5	152.1	-96.3	145.8	0	0	0	107.5
192	D	44.4	Very low	50.7	Low	145 Å²	145	122.7 Å²	122.7	78%	0.775	80%	0.801	S	S	*	*			trans	-88.8	160	174.7	-97.4	-54.2	0	0	0	112.4
193	S	57.9	Low	50.7	Low	119 Å²	119	120.8 Å²	120.8	83%	0.832	80%	0.8	S	S	*	*			trans	-160	102	158.1	-79.9	0	0	0	0	111.8
194	T	46.3	Very low	50.1	Low	124 Å²	124	128.8 Å²	128.8	76%	0.761	81%	0.806	S	S	*	*			trans	-99.6	137.1	-178.1	-38.1	0	0	0	0	111.3
195	T	60.1	Low	50	Low	137 Å²	137	126.7 Å²	126.7	84%	0.84	80%	0.797	S	S	*	*			trans	-142.3	135.4	171.4	-49.7	0	0	0	0	112.7
196	T	48	Very low	50.2	Low	117 Å²	117	128.9 Å²	128.9	72%	0.718	81%	0.807	S	S	*	*			trans	-118	171.3	177.6	46.6	0	0	0	0	110.5
197	V	48.4	Very low	49.9	Very low	136 Å²	136	128 Å²	128	82%	0.824	80%	0.801	S	S	*	*			cis	-117.6	-137.3	10.3	-143.1	0	0	0	0	110.1
198	S	49.6	Very low	49.9	Very low	114 Å²	114	127.5 Å²	127.5	80%	0.797	80%	0.803	S	S	*	*			cis	-152.4	179.1	6.2	-160.5	0	0	0	0	110.3
199	S	47.4	Very low	49.5	Very low	106 Å²	106	126.8 Å²	126.8	74%	0.741	80%	0.798	S	S	*	*			trans	-143.1	136.4	-172	55.8	0	0	0	0	116.2
200	S	53.7	Low	49.6	Very low	116 Å²	116	128.8 Å²	128.8	81%	0.811	81%	0.806	S	S	*	*			trans	-170.1	132	155.3	45.9	0	0	0	0	107.7
201	V	51.4	Low	49.7	Very low	136 Å²	136	125.7 Å²	125.7	82%	0.824	79%	0.793	S	S	*	*			cis	107.5	118.4	21.9	172.7	0	0	0	0	112.6
202	A	48	Very low	49.2	Very low	108 Å²	108	124.8 Å²	124.8	89%	0.893	80%	0.795	S	S	*	*			trans	68.9	143.8	171.4	0	0	0	0	0	118.9
203	G	47.8	Very low	49.5	Very low	80 Å²	80	123.3 Å²	123.3	83%	0.825	80%	0.796	S	S	*	*			trans	168.1	20	179.2	0	0	0	0	0	120.6
204	R	48.2	Very low	49	Very low	243 Å²	243	123.9 Å²	123.9	92%	0.917	80%	0.795	S	S	*	*			trans	-6.9	111.6	171.4	-179.8	-179.9	172.1	164.2	-2.2	120
205	S	45.6	Very low	49.1	Very low	98 Å²	98	127 Å²	127	69%	0.685	80%	0.801	S	S	*	*			trans	28.3	127.4	133.8	-171.2	0	0	0	0	122.3
206	T	50.7	Low	48.6	Very low	146 Å²	146	125 Å²	125	90%	0.896	79%	0.792	S	S	*	*				-166.8	173.1	114.4	23.3	0	0	0	0	113.2
207	V	44.4	Very low	48.8	Very low	126 Å²	126	129.5 Å²	129.5	76%	0.764	80%	0.802	S	S	*	*			trans	-120.5	134.7	-173.1	171.6	0	0	0	0	112.5
208	S	45.7	Very low	48.8	Very low	112 Å²	112	129.1 Å²	129.1	78%	0.783	80%	0.8	S	S	*	*			trans	-177.8	128.1	146.6	-77	0	0	0	0	107.2
209	T	46.1	Very low	49.3	Very low	118 Å²	118	130.5 Å²	130.5	72%	0.724	80%	0.804	S	S	*	*				78.4	134.7	50.9	-46.9	0	0	0	0	112.9
210	T	49.9	Very low	49.3	Very low	139 Å²	139	128.5 Å²	128.5	85%	0.853	80%	0.8	S	S	*	*			trans	78.4	137.2	-169.4	-30.2	0	0	0	0	113.2
211	G	48.5	Very low	49.7	Very low	51 Å²	51	128.6 Å²	128.6	53%	0.526	80%	0.801	S	S	.	*			cis	139.3	140.5	-5.3	0	0	0	0	0	112.1
212	T	52	Low	49.7	Very low	149 Å²	149	131.5 Å²	131.5	91%	0.914	81%	0.805	S	S	*	*			trans	64.4	161.3	-176.5	78.4	0	0	0	0	114.3
213	S	49.7	Very low	50.4	Low	114 Å²	114	132.8 Å²	132.8	80%	0.797	80%	0.802	S	S	*	*			cis	-143.1	171.8	-18.1	-164.1	0	0	0	0	109.3
214	V	47.4	Very low	50.8	Low	132 Å²	132	135.5 Å²	135.5	80%	0.8	80%	0.803	S	S	*	*			trans	-72.2	142.1	168.9	-145.1	0	0	0	0	110.6
215	E	49	Very low	51.6	Low	189 Å²	189	128.9 Å²	128.9	88%	0.883	80%	0.8	S	S	*	*			trans	-154.9	164.2	138.2	-128.4	172.6	-176.3	0	0	112
216	S	49.3	Very low	52.7	Low	94 Å²	94	129.8 Å²	129.8	66%	0.657	81%	0.806	S	S	*	*			trans	-107	151.2	-160.1	53.9	0	0	0	0	114.4
217	F	51.6	Low	53	Low	212 Å²	212	131 Å²	131	93%	0.93	81%	0.807	S	S	*	*			trans	-125.4	127.7	162.4	-86.1	-81.4	0	0	0	112.8
218	T	49.8	Very low	53.8	Low	128 Å²	128	128.6 Å²	128.6	79%	0.785	81%	0.808	S	S	*	*			trans	-100.7	127.7	178.4	-58.6	0	0	0	0	110
219	V	60	Low	54.5	Low	144 Å²	144	128.6 Å²	128.6	87%	0.873	81%	0.808	S	S	*	*			trans	-140.8	128.7	154.1	-174.7	0	0	0	0	107.5
220	G	46.2	Very low	55.3	Low	64 Å²	64	132.7 Å²	132.7	66%	0.66	82%	0.816	S	S	*	*			trans	-123.8	158.4	170.7	0	0	0	0	0	110.5
221	S	61.6	Low	55.9	Low	118 Å²	118	130.9 Å²	130.9	83%	0.825	81%	0.806	S	S	*	*			trans	-153	128.4	162.9	-79.6	0	0	0	0	108.2
222	E	53.1	Low	56.3	Low	196 Å²	196	137 Å²	137	92%	0.916	82%	0.821	S	S	*	*			trans	-78.8	150.2	168.9	-68.2	168.7	72.9	0	0	110.5
223	T	61.2	Low	56.4	Low	135 Å²	135	139.4 Å²	139.4	83%	0.828	82%	0.821	S	S	*	*			trans	-142.7	128.9	159	-24.1	0	0	0	0	110.9
224	T	57.4	Low	57.4	Low	137 Å²	137	139.6 Å²	139.6	84%	0.84	82%	0.822	S	S	*	*			trans	-53.9	133.2	-177.1	48.2	0	0	0	0	114.6
225	A	63.4	Low	58.3	Low	105 Å²	105	148.1 Å²	148.1	87%	0.868	84%	0.843	S	S	*	*			trans	-84.6	136.3	159.4	0	0	0	0	0	110.3
226	S	69.7	Low	58.7	Low	116 Å²	116	146.1 Å²	146.1	81%	0.811	84%	0.841	S	S	*	*			trans	-107.7	129.8	178.6	-175.6	0	0	0	0	110.9
227	N	56.7	Low	59.2	Low	172 Å²	172	148.8 Å²	148.8	92%	0.92	85%	0.85	S	S	*	*			trans	-92.2	114.9	171	-81.7	-23.2	0	0	0	109.7
228	G	60.5	Low	59.7	Low	76 Å²	76	145.3 Å²	145.3	78%	0.784	85%	0.846	S	S	*	*			trans	-136.6	112.6	171.6	0	0	0	0	0	110.3
229	S	60.6	Low	60.2	Low	112 Å²	112	146.4 Å²	146.4	78%	0.783	85%	0.849	S	S	*	*			trans	-79.5	150.2	172.7	49.4	0	0	0	0	111.1
230	F	63.9	Low	60.3	Low	203 Å²	203	146.5 Å²	146.5	89%	0.89	85%	0.848	S	S	*	*			trans	-132.5	140.8	162.2	-156.7	-91.4	0	0	0	109.2
231	T	63.1	Low	61.2	Low	102 Å²	102	152 Å²	152	63%	0.626	86%	0.86	S	S	*	*			trans	-131.6	150.6	-163.3	-37.5	0	0	0	0	110.4
232	Q	56	Low	61.2	Low	180 Å²	180	154.4 Å²	154.4	84%	0.841	86%	0.863	S	S	*	*			trans	59.6	119.7	164.2	-88.3	176.5	-21.4	0	0	118.6
233	Q	54.4	Low	61.8	Low	198 Å²	198	151.2 Å²	151.2	93%	0.925	86%	0.859	S	S	*	*				-150	119.7	125.4	-114.3	-179.9	10	0	0	109.8
234	S	70.5	Confident	61.8	Low	118 Å²	118	152.6 Å²	152.6	83%	0.825	86%	0.861	S	S	*	*			trans	-156.4	137.3	163.6	-85.4	0	0	0	0	107.5
235	Y	65.7	Low	62.2	Low	312 Å²	312	154 Å²	154	100%	1.224	86%	0.863	S	S	*	*			trans	-24.1	0	178.4	-67.9	-91	0	0	0	117.4

Retrieved 235 of 235 residues in 177.1 ms (Link to these results)

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